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Carboxylic acid esters

Organic compounds that are directly derived from carboxylic acid, and contain an ester functional group substitution; ester groups contain an oxygen atom that is bonded to two carbon atoms or organic groups via single bonds.

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1 – 15 of 26 results
1

Methyl (S)-(-)-lactate, 97%

CAS: 27871-49-4 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00064265 InChI Key: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonym: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester PubChem CID: 94386 ChEBI: CHEBI:83222 IUPAC Name: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O

PubChem CID 94386
CAS 27871-49-4
Molecular Weight (g/mol) 104.11
ChEBI CHEBI:83222
MDL Number MFCD00064265
SMILES COC(=O)[C@H](C)O
Synonym methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester
IUPAC Name methyl (2S)-2-hydroxypropanoate
InChI Key LPEKGGXMPWTOCB-VKHMYHEASA-N
Molecular Formula C4H8O3
2

Methyl (S)-(-)-lactate, 97%

CAS: 27871-49-4 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00064265 InChI Key: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonym: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester PubChem CID: 94386 ChEBI: CHEBI:83222 IUPAC Name: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O

PubChem CID 94386
CAS 27871-49-4
Molecular Weight (g/mol) 104.11
ChEBI CHEBI:83222
MDL Number MFCD00064265
SMILES COC(=O)[C@H](C)O
Synonym methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester
IUPAC Name methyl (2S)-2-hydroxypropanoate
InChI Key LPEKGGXMPWTOCB-VKHMYHEASA-N
Molecular Formula C4H8O3
4

Methyl 2-methylbutyrate, 98%

CAS: 868-57-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009335 InChI Key: OCWLYWIFNDCWRZ-UHFFFAOYNA-N Synonym: methyl 2-methylbutyrate,butanoic acid, 2-methyl-, methyl ester,methyl 2-methyl butyrate,methyl s-2-methylbutanoate,2-methylbutyric acid methyl ester,butyric acid, 2-methyl-, methyl ester,dl-2-methylbutyric acid methyl ester,methyl dl-2-methylbutyrate,methyl alpha-methylbutyrate,methyl alpha-methylbutanoate PubChem CID: 13357 IUPAC Name: methyl 2-methylbutanoate SMILES: CCC(C)C(=O)OC

PubChem CID 13357
CAS 868-57-5
Molecular Weight (g/mol) 116.16
MDL Number MFCD00009335
SMILES CCC(C)C(=O)OC
Synonym methyl 2-methylbutyrate,butanoic acid, 2-methyl-, methyl ester,methyl 2-methyl butyrate,methyl s-2-methylbutanoate,2-methylbutyric acid methyl ester,butyric acid, 2-methyl-, methyl ester,dl-2-methylbutyric acid methyl ester,methyl dl-2-methylbutyrate,methyl alpha-methylbutyrate,methyl alpha-methylbutanoate
IUPAC Name methyl 2-methylbutanoate
InChI Key OCWLYWIFNDCWRZ-UHFFFAOYNA-N
Molecular Formula C6H12O2
5

Methyl 2-methylbutyrate, 98%

CAS: 868-57-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009335 InChI Key: OCWLYWIFNDCWRZ-UHFFFAOYNA-N Synonym: methyl 2-methylbutyrate,butanoic acid, 2-methyl-, methyl ester,methyl 2-methyl butyrate,methyl s-2-methylbutanoate,2-methylbutyric acid methyl ester,butyric acid, 2-methyl-, methyl ester,dl-2-methylbutyric acid methyl ester,methyl dl-2-methylbutyrate,methyl alpha-methylbutyrate,methyl alpha-methylbutanoate PubChem CID: 13357 IUPAC Name: methyl 2-methylbutanoate SMILES: CCC(C)C(=O)OC

PubChem CID 13357
CAS 868-57-5
Molecular Weight (g/mol) 116.16
MDL Number MFCD00009335
SMILES CCC(C)C(=O)OC
Synonym methyl 2-methylbutyrate,butanoic acid, 2-methyl-, methyl ester,methyl 2-methyl butyrate,methyl s-2-methylbutanoate,2-methylbutyric acid methyl ester,butyric acid, 2-methyl-, methyl ester,dl-2-methylbutyric acid methyl ester,methyl dl-2-methylbutyrate,methyl alpha-methylbutyrate,methyl alpha-methylbutanoate
IUPAC Name methyl 2-methylbutanoate
InChI Key OCWLYWIFNDCWRZ-UHFFFAOYNA-N
Molecular Formula C6H12O2
6
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Hydroxypropyl methacrylate, 97+%, mixture of isomers, stabilized

CAS: 27813-02-1 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00004536 InChI Key: ZMARGGQEAJXRFP-UHFFFAOYNA-N Synonym: 2-hydroxypropyl methacrylate,2-hydroxypropylmethacrylate,hpma,beta-hydroxypropyl methacrylate,acryester hp,2-hydroxypropyl 2-methylacrylate,poly 2-hydroxypropyl methacrylate,2-hydroxypropyl 2-methyl-2-propenoate,2-propenoic acid, 2-methyl-, 2-hydroxypropyl ester,2-hpma PubChem CID: 13539 ChEBI: CHEBI:53440 IUPAC Name: 2-hydroxypropyl 2-methylprop-2-enoate SMILES: CC(CO)OC(=O)C(C)=C

PubChem CID 13539
CAS 27813-02-1
Molecular Weight (g/mol) 144.17
ChEBI CHEBI:53440
MDL Number MFCD00004536
SMILES CC(CO)OC(=O)C(C)=C
Synonym 2-hydroxypropyl methacrylate,2-hydroxypropylmethacrylate,hpma,beta-hydroxypropyl methacrylate,acryester hp,2-hydroxypropyl 2-methylacrylate,poly 2-hydroxypropyl methacrylate,2-hydroxypropyl 2-methyl-2-propenoate,2-propenoic acid, 2-methyl-, 2-hydroxypropyl ester,2-hpma
IUPAC Name 2-hydroxypropyl 2-methylprop-2-enoate
InChI Key ZMARGGQEAJXRFP-UHFFFAOYNA-N
Molecular Formula C7H12O3
7

Methyl 2-chloropropionate, 97%

CAS: 17639-93-9 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.55 MDL Number: MFCD00000863 InChI Key: JLEJCNOTNLZCHQ-UHFFFAOYNA-N Synonym: methyl 2-chloropropionate,propanoic acid, 2-chloro-, methyl ester,2-chloropropionic acid methyl ester,propionic acid, 2-chloro-, methyl ester,methyl alpha-chloropropionate,methyl .alpha.-chloropropionate,.alpha.-chloropropionic acid methyl ester,propanoic acid, 2-chloro-, methyl ester, s,ch3chclc o och3,acmc-1bl6f PubChem CID: 28659 IUPAC Name: methyl 2-chloropropanoate SMILES: COC(=O)C(C)Cl

PubChem CID 28659
CAS 17639-93-9
Molecular Weight (g/mol) 122.55
MDL Number MFCD00000863
SMILES COC(=O)C(C)Cl
Synonym methyl 2-chloropropionate,propanoic acid, 2-chloro-, methyl ester,2-chloropropionic acid methyl ester,propionic acid, 2-chloro-, methyl ester,methyl alpha-chloropropionate,methyl .alpha.-chloropropionate,.alpha.-chloropropionic acid methyl ester,propanoic acid, 2-chloro-, methyl ester, s,ch3chclc o och3,acmc-1bl6f
IUPAC Name methyl 2-chloropropanoate
InChI Key JLEJCNOTNLZCHQ-UHFFFAOYNA-N
Molecular Formula C4H7ClO2
8

Methyl 3-mercaptopropionate, 98%

CAS: 2935-90-2 Molecular Formula: C4H8O2S Molecular Weight (g/mol): 120.17 MDL Number: MFCD00004895 InChI Key: LDTLDBDUBGAEDT-UHFFFAOYSA-N PubChem CID: 18050 IUPAC Name: methyl 3-sulfanylpropanoate SMILES: COC(=O)CCS

PubChem CID 18050
CAS 2935-90-2
Molecular Weight (g/mol) 120.17
MDL Number MFCD00004895
SMILES COC(=O)CCS
IUPAC Name methyl 3-sulfanylpropanoate
InChI Key LDTLDBDUBGAEDT-UHFFFAOYSA-N
Molecular Formula C4H8O2S
9

Clopidogrel hydrogen sulfate, MedChemExpress

MedChemExpress Clopidogrel hydrogen sulfate is an antiplatelet agent to prevent blood clots. Clopidogrel hydrogen sulfate inhibits CYP2B6 and CYP2C19 with IC50s of 18.2 nM and 524 nM, respectively. Clopidogrel hydrogen sulfate is a potent antithrombotic agent that inhibits ADP-induced platelet aggregation.Clopidogrel hydrogen sulfate also is an orally active P2Y(12) inhibitor.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 419.9
Color Light Yellow
Physical Form Solid
Chemical Name or Material Clopidogrel hydrogen sulfate
Grade Research
SMILES ClC1=C([C@@H](C(OC)=O)N2CCC3=C(C=CS3)C2)C=CC=C1.O=S(O)(O)=O
For Use With (Application) COVID-19-immunoregulation
Percent Purity 99.08%
CAS 120202-66-6
Solubility Information DMSO : ≥ 46.7 mg/mL (111.22 mM) ∣H2O : 16.67 mg/mL (39.70 mM; Need ultrasonic)
Health Hazard 1 H302∣H312∣H332
Synonym (S)-(+)-Clopidogrel bisulfate (S)-(+)-Clopidogrel hydrogen sulfate
Purity Grade Notes Research
Recommended Storage 4°C, sealed storage, away from moisture∣In solvent : -80°C, 6 months∣-20°C, 1 month (sealed storage, away from moisture)
Shelf Life 4°C, sealed storage, away from moisture∣In solvent : -80°C, 6 months∣-20°C, 1 month (sealed storage, away from moisture)
Molecular Formula C16H18ClNO6S2
Formula Weight 419.9
10

Clopidogrel thiolactone, MedChemExpress

MedChemExpress Clopidogrel thiolactone is a P2Y12 receptor inhibitor, is a potent antiplatelet agent.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 337.82
Color Reddish Brown
Physical Form Solid
Chemical Name or Material Clopidogrel thiolactone
Grade Research
SMILES O=C(OC)[C@@H](N1CCC(S2)C(C1)=CC2=O)C3=C(Cl)C=CC=C3
For Use With (Application) COVID-19-immunoregulation
Percent Purity 98.0%
CAS 1147350-75-1
Solubility Information DMSO : 50 mg/mL (148.01 mM; Need ultrasonic)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C16H16ClNO3S
Formula Weight 337.82
11

ZXH-3-26, MedChemExpress

MedChemExpress ZXH-3-26 is a PROTAC connected by ligands for Cereblon and BRD4 with a DC50/5h of 5 nM. The DC50/5h refers to half-maximal degradation after 5 hours of treatment of ∼ 5 nM.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 785.27
Color Yellow
Physical Form Solid
Chemical Name or Material ZXH-3-26
Grade Research
SMILES O=C(OC)C[C@H]1C2=NN=C(C)N2C3=C(C(C)=C(C(NCCCCCNC4=CC=CC(C(N5C(CC6)C(NC6=O)=O)=O)=C4C5=O)=O)S3)C(C7=CC=C(Cl)C=C7)=N1
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.61%
CAS 2243076-67-5
Solubility Information DMSO : 200 mg/mL (254.69 mM; Need ultrasonic)
Purity Grade Notes Research
Recommended Storage -20°C, stored under nitrogen∣In solvent : -80°C, 6 months∣-20°C, 1 month (stored under nitrogen)
Shelf Life -20°C, stored under nitrogen∣In solvent : -80°C, 6 months∣-20°C, 1 month (stored under nitrogen)
Molecular Formula C38H37ClN8O7S
Formula Weight 785.27
12

MS417, MedChemExpress

MedChemExpress MS417 is a selective BET-specific BRD4 inhibitor, binds to BRD4-BD1 and BRD4-BD2 with IC50s of 30, 46 nM and Kds of 36.1, 25.4 nM, respectively, with weak selectivity at CBP BRD (IC50, 32.7 μM).

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 414.91
Color Yellow
Physical Form Solid
Chemical Name or Material MS417
Grade Research
SMILES O=C(OC)C[C@H]1C2=NN=C(C)N2C3=C(C(C)=C(C)S3)C(C4=CC=C(Cl)C=C4)=N1
For Use With (Application) COVID-19-anti-virus
Percent Purity 96.47%
CAS 916489-36-6
Solubility Information Ethanol : 50 mg/mL (120.51 mM; Need ultrasonic)
Synonym GTPL7512
Purity Grade Notes Research
Recommended Storage 4°C, stored under nitrogen∣In solvent : -80°C, 6 months∣-20°C, 1 month (stored under nitrogen)
Shelf Life 4°C, stored under nitrogen∣In solvent : -80°C, 6 months∣-20°C, 1 month (stored under nitrogen)
Molecular Formula C20H19ClN4O2S
Formula Weight 414.91
13

ITE, MedChemExpress

MedChemExpress ITE is a potent endogenous agonist of aryl hydrocarbon receptor (AhR), binding directly to AHR, with a Ki of 3 nM. ITE also has immunosuppressive activity.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 286.31
Color Light Yellow
Physical Form Solid
Chemical Name or Material ITE
Grade Research
SMILES O=C(C1=CSC(C(C2=CNC3=C2C=CC=C3)=O)=N1)OC
For Use With (Application) COVID-19-immunoregulation
Percent Purity 98.0%
CAS 448906-42-1
Solubility Information DMSO : ≥ 41 mg/mL (143.20 mM)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C14H10N2O3S
Formula Weight 286.31
14

PROTAC BET-binding moiety 2, MedChemExpress

MedChemExpress PROTAC BET-binding moiety 2 is an inhibitor of BET bromodomain.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 444.89
Color White
Physical Form Solid
Chemical Name or Material PROTAC BET-binding moiety 2
Grade Research
SMILES CC1=C(C(O)=O)SC2=C1C(C3=CC=C(Cl)C=C3)=N[C@@H](CC(OC)=O)C4=NN=C(C)N24
For Use With (Application) Cancer-programmed cell death
Percent Purity 98.85%
CAS 916493-82-8
Solubility Information DMSO : 42.86 mg/mL (96.34 mM; Need ultrasonic)
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C20H17ClN4O4S
Formula Weight 444.89
15

GSK0660, MedChemExpress

MedChemExpress GSK0660 is a potent antagonist of PPARβ and PPARδ, with IC50s of 155 nM for both isoforms.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 418.49
Color Light Yellow
Physical Form Solid
Chemical Name or Material GSK0660
Grade Research
SMILES O=C(C1=C(S(=O)(NC2=CC=C(NC3=CC=CC=C3)C=C2OC)=O)C=CS1)OC
For Use With (Application) Metabolism-protein/nucleotide metabolism
Percent Purity 99.55%
CAS 1014691-61-2
Solubility Information DMSO : ≥ 49 mg/mL (117.09 mM)
Health Hazard 1 H302∣H315∣H319∣H335
Purity Grade Notes Research
Recommended Storage Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula C19H18N2O5S2
Formula Weight 418.49