Alkyl Halides

Organic compounds in which a hydrogen atom or more has been replaced by a halogen atom in an alkane molecule (saturated hydrocarbon chain). Halogen atoms include bromine, chlorine, fluorine, and iodine. Compounds may be in closed ring configurations.

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Copper(I) Trifluoromethanethiolate, TRC

CAS: 3872-23-9 Molecular Formula: CCuF3S Molecular Weight (g/mol): 164.62 Synonym: Methanethiol, trifluoro-, copper(1+) salt (8CI,9CI),(Trifluoromethylthio)copper,(Trifluoromethylthio)copper(I),Copper (trifluoromethyl)mercaptide,Copper(1+) trifluoromethanethiolate,Copper(I) trifluoromethanethiolate,Cuprous trifloromethanethiolate,Trifluoromethanethiol copper salt (1:1) IUPAC Name: copper(1+);trifluoromethanethiolate SMILES: [Cu+].FC(F)(F)[S-]

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CAS	3872-23-9
Molecular Weight (g/mol)	164.62
SMILES	[Cu+].FC(F)(F)[S-]
Synonym	Methanethiol, trifluoro-, copper(1+) salt (8CI,9CI),(Trifluoromethylthio)copper,(Trifluoromethylthio)copper(I),Copper (trifluoromethyl)mercaptide,Copper(1+) trifluoromethanethiolate,Copper(I) trifluoromethanethiolate,Cuprous trifloromethanethiolate,Trifluoromethanethiol copper salt (1:1)
IUPAC Name	copper(1+);trifluoromethanethiolate
Molecular Formula	CCuF3S

Diiodomethane, 99+%, stabilized with silver wire

CAS: 75-11-6 Molecular Formula: CH2I2 Molecular Weight (g/mol): 267.84 MDL Number: MFCD00001079 InChI Key: NZZFYRREKKOMAT-UHFFFAOYSA-N Synonym: methylene iodide,methane, diiodo,methylene diiodide,mi-gee,dijodmethan,methylenjodid,dijodmethan czech,methylenjodid czech,di-iodomethane,diiodo-methane PubChem CID: 6346 IUPAC Name: diiodomethane SMILES: ICI

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PubChem CID	6346
CAS	75-11-6
Molecular Weight (g/mol)	267.84
MDL Number	MFCD00001079
SMILES	ICI
Synonym	methylene iodide,methane, diiodo,methylene diiodide,mi-gee,dijodmethan,methylenjodid,dijodmethan czech,methylenjodid czech,di-iodomethane,diiodo-methane
IUPAC Name	diiodomethane
InChI Key	NZZFYRREKKOMAT-UHFFFAOYSA-N
Molecular Formula	CH2I2

Iodomethane, 99%, stabilized

CAS: 74-88-4 Molecular Formula: CH3I Molecular Weight (g/mol): 141.94 MDL Number: MFCD00001073 InChI Key: INQOMBQAUSQDDS-UHFFFAOYSA-N Synonym: methyl iodide,monoiodomethane,methane, iodo,methyljodid,jod-methan,methyliodide,methyljodide,iodometano,joodmethaan,metylu jodek PubChem CID: 6328 ChEBI: CHEBI:39282 IUPAC Name: iodomethane SMILES: CI

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PubChem CID	6328
CAS	74-88-4
Molecular Weight (g/mol)	141.94
ChEBI	CHEBI:39282
MDL Number	MFCD00001073
SMILES	CI
Synonym	methyl iodide,monoiodomethane,methane, iodo,methyljodid,jod-methan,methyliodide,methyljodide,iodometano,joodmethaan,metylu jodek
IUPAC Name	iodomethane
InChI Key	INQOMBQAUSQDDS-UHFFFAOYSA-N
Molecular Formula	CH3I

Iodoform, 99%

CAS: 75-47-8 Molecular Formula: CHI3 Molecular Weight (g/mol): 393.732 MDL Number: MFCD00001069 InChI Key: OKJPEAGHQZHRQV-UHFFFAOYSA-N Synonym: triiodomethane,methane, triiodo,carbon triiodide,jodoform,trijodmethane,dezinfekt v,jodoform czech,trijodmethane czech,ccris 346,unii-kxi2j76489 PubChem CID: 6374 ChEBI: CHEBI:37758 IUPAC Name: iodoform SMILES: C(I)(I)I

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PubChem CID	6374
CAS	75-47-8
Molecular Weight (g/mol)	393.732
ChEBI	CHEBI:37758
MDL Number	MFCD00001069
SMILES	C(I)(I)I
Synonym	triiodomethane,methane, triiodo,carbon triiodide,jodoform,trijodmethane,dezinfekt v,jodoform czech,trijodmethane czech,ccris 346,unii-kxi2j76489
IUPAC Name	iodoform
InChI Key	OKJPEAGHQZHRQV-UHFFFAOYSA-N
Molecular Formula	CHI3

PubChem CID	6328
CAS	74-88-4
Molecular Weight (g/mol)	141.94
ChEBI	CHEBI:39282
MDL Number	MFCD00001073
SMILES	CI
Synonym	methyl iodide,monoiodomethane,methane, iodo,methyljodid,jod-methan,methyliodide,methyljodide,iodometano,joodmethaan,metylu jodek
IUPAC Name	iodomethane
InChI Key	INQOMBQAUSQDDS-UHFFFAOYSA-N
Molecular Formula	CH3I

(2-Iodoethyl)benzene, 97%, stabilized with copper

CAS: 17376-04-4 Molecular Formula: C₈H₉I Molecular Weight (g/mol): 232.07 MDL Number: MFCD00039408 InChI Key: KVTHPKXDLVYNCH-UHFFFAOYSA-N Synonym: 2-iodoethyl benzene,benzene, 2-iodoethyl,2-phenylethyl iodide,phenethyl iodide,iodoethyl benzene,.beta.-phenethyl iodide,phenethyliodide,p-iodoethylbenzene,phenylethyl iodide,4-iodoethylbenzene PubChem CID: 28503 IUPAC Name: 2-iodoethylbenzene SMILES: C1=CC=C(C=C1)CCI

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PubChem CID	28503
CAS	17376-04-4
Molecular Weight (g/mol)	232.07
MDL Number	MFCD00039408
SMILES	C1=CC=C(C=C1)CCI
Synonym	2-iodoethyl benzene,benzene, 2-iodoethyl,2-phenylethyl iodide,phenethyl iodide,iodoethyl benzene,.beta.-phenethyl iodide,phenethyliodide,p-iodoethylbenzene,phenylethyl iodide,4-iodoethylbenzene
IUPAC Name	2-iodoethylbenzene
InChI Key	KVTHPKXDLVYNCH-UHFFFAOYSA-N
Molecular Formula	C₈H₉I

Iodoform, 99+%

CAS: 75-47-8 Molecular Formula: CHI₃ Molecular Weight (g/mol): 393.72 MDL Number: MFCD00001069 InChI Key: OKJPEAGHQZHRQV-UHFFFAOYSA-N Synonym: triiodomethane,methane, triiodo,carbon triiodide,jodoform,trijodmethane,dezinfekt v,jodoform czech,trijodmethane czech,ccris 346,unii-kxi2j76489 PubChem CID: 6374 ChEBI: CHEBI:37758 IUPAC Name: iodoform SMILES: C(I)(I)I

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PubChem CID	6374
CAS	75-47-8
Molecular Weight (g/mol)	393.72
ChEBI	CHEBI:37758
MDL Number	MFCD00001069
SMILES	C(I)(I)I
Synonym	triiodomethane,methane, triiodo,carbon triiodide,jodoform,trijodmethane,dezinfekt v,jodoform czech,trijodmethane czech,ccris 346,unii-kxi2j76489
IUPAC Name	iodoform
InChI Key	OKJPEAGHQZHRQV-UHFFFAOYSA-N
Molecular Formula	CHI₃

Chloroiodomethane, 98%, stabilized

CAS: 593-71-5 Molecular Formula: CH₂ClI Molecular Weight (g/mol): 176.38 InChI Key: PJGJQVRXEUVAFT-UHFFFAOYSA-N Synonym: chloro iodo methane,methane, chloroiodo,methylene chloroiodide,chloro-iodomethane,chloro-iodo-methane,iodochloromethane,chlor iod methan,chloroiodo-methane,chloromethyl iodide,qmablxaih@ PubChem CID: 11644 IUPAC Name: chloro(iodo)methane SMILES: C(Cl)I

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PubChem CID	11644
CAS	593-71-5
Molecular Weight (g/mol)	176.38
SMILES	C(Cl)I
Synonym	chloro iodo methane,methane, chloroiodo,methylene chloroiodide,chloro-iodomethane,chloro-iodo-methane,iodochloromethane,chlor iod methan,chloroiodo-methane,chloromethyl iodide,qmablxaih@
IUPAC Name	chloro(iodo)methane
InChI Key	PJGJQVRXEUVAFT-UHFFFAOYSA-N
Molecular Formula	CH₂ClI

Iodoacetic Anhydride, 97%

CAS: 54907-61-8 Molecular Formula: C₄H₄I₂O₃ Molecular Weight (g/mol): 353.88 MDL Number: MFCD00001080 InChI Key: RBNSZWOCWHGHMR-UHFFFAOYSA-N Synonym: iodoacetic anhydride,di iodoacetic anhydride,acmc-20akq5,iodoacetic acid anhydride,2-iodoacetyl 2-iodoacetate,acetic acid, iodo-, anhydride,acetic acid, 2-iodo-,1,1'-anhydride,iodoacetic anhydride, technical t PubChem CID: 2733254 IUPAC Name: (2-iodoacetyl) 2-iodoacetate SMILES: C(C(=O)OC(=O)CI)I

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PubChem CID	2733254
CAS	54907-61-8
Molecular Weight (g/mol)	353.88
MDL Number	MFCD00001080
SMILES	C(C(=O)OC(=O)CI)I
Synonym	iodoacetic anhydride,di iodoacetic anhydride,acmc-20akq5,iodoacetic acid anhydride,2-iodoacetyl 2-iodoacetate,acetic acid, iodo-, anhydride,acetic acid, 2-iodo-,1,1'-anhydride,iodoacetic anhydride, technical t
IUPAC Name	(2-iodoacetyl) 2-iodoacetate
InChI Key	RBNSZWOCWHGHMR-UHFFFAOYSA-N
Molecular Formula	C₄H₄I₂O₃

3-Iodo-1-phenylpropane, 97%

CAS: 4119-41-9 Molecular Formula: C9H11I Molecular Weight (g/mol): 246.09 MDL Number: MFCD00019036 InChI Key: RGCKJSPKMTWLLX-UHFFFAOYSA-N Synonym: 1-iodo-3-phenylpropane,3-iodopropyl benzene,benzene, 3-iodopropyl,g-phenyl propyliodine,3-phenylpropyl iodide,l-iodo-3-phenylpropane,acmc-20aou9,3-phenyl-1-iodopropane,phch2ch2ch2i,3-iodo-1-phenylpropane PubChem CID: 138121 IUPAC Name: 3-iodopropylbenzene SMILES: ICCCC1=CC=CC=C1

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PubChem CID	138121
CAS	4119-41-9
Molecular Weight (g/mol)	246.09
MDL Number	MFCD00019036
SMILES	ICCCC1=CC=CC=C1
Synonym	1-iodo-3-phenylpropane,3-iodopropyl benzene,benzene, 3-iodopropyl,g-phenyl propyliodine,3-phenylpropyl iodide,l-iodo-3-phenylpropane,acmc-20aou9,3-phenyl-1-iodopropane,phch2ch2ch2i,3-iodo-1-phenylpropane
IUPAC Name	3-iodopropylbenzene
InChI Key	RGCKJSPKMTWLLX-UHFFFAOYSA-N
Molecular Formula	C9H11I

Iodomethane, 99%, stab. with copper

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PubChem CID	6328
CAS	74-88-4
Molecular Weight (g/mol)	141.94
ChEBI	CHEBI:39282
MDL Number	MFCD00001073
SMILES	CI
Synonym	methyl iodide,monoiodomethane,methane, iodo,methyljodid,jod-methan,methyliodide,methyljodide,iodometano,joodmethaan,metylu jodek
IUPAC Name	iodomethane
InChI Key	INQOMBQAUSQDDS-UHFFFAOYSA-N
Molecular Formula	CH3I

1,10-Dibromodecane, 97%

CAS: 4101-68-2 Molecular Formula: C10H20Br2 Molecular Weight (g/mol): 300.08 MDL Number: MFCD00000222 InChI Key: GTQHJCOHNAFHRE-UHFFFAOYSA-N Synonym: decamethylene dibromide,decane, 1,10-dibromo,1,10-dibromodecan,1,10-dibromo-decan,1,10-decamethylene bromide,1,10-decamethylene dibromide,a,w-dibromodecane,1,10-dibromdecane,1,10 dibromodecane,decane,10-dibromo PubChem CID: 221483 IUPAC Name: 1,10-dibromodecane SMILES: BrCCCCCCCCCCBr

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PubChem CID	221483
CAS	4101-68-2
Molecular Weight (g/mol)	300.08
MDL Number	MFCD00000222
SMILES	BrCCCCCCCCCCBr
Synonym	decamethylene dibromide,decane, 1,10-dibromo,1,10-dibromodecan,1,10-dibromo-decan,1,10-decamethylene bromide,1,10-decamethylene dibromide,a,w-dibromodecane,1,10-dibromdecane,1,10 dibromodecane,decane,10-dibromo
IUPAC Name	1,10-dibromodecane
InChI Key	GTQHJCOHNAFHRE-UHFFFAOYSA-N
Molecular Formula	C10H20Br2

1-Bromooctadecane, 96%

CAS: 112-89-0 Molecular Formula: C18H37Br Molecular Weight (g/mol): 333.40 MDL Number: MFCD00000231 InChI Key: WSULSMOGMLRGKU-UHFFFAOYSA-N Synonym: octadecyl bromide,stearyl bromide,octadecane, 1-bromo,n-octadecyl bromide,bromooctadecane,octadecylbromide,1-bromoctadecane,n-octadecylbromide,1-bromooctodecane,bromo-n-octadecane PubChem CID: 8218 IUPAC Name: 1-bromooctadecane SMILES: CCCCCCCCCCCCCCCCCCBr

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PubChem CID	8218
CAS	112-89-0
Molecular Weight (g/mol)	333.40
MDL Number	MFCD00000231
SMILES	CCCCCCCCCCCCCCCCCCBr
Synonym	octadecyl bromide,stearyl bromide,octadecane, 1-bromo,n-octadecyl bromide,bromooctadecane,octadecylbromide,1-bromoctadecane,n-octadecylbromide,1-bromooctodecane,bromo-n-octadecane
IUPAC Name	1-bromooctadecane
InChI Key	WSULSMOGMLRGKU-UHFFFAOYSA-N
Molecular Formula	C18H37Br

Diiododifluoromethane, TRC

CAS: 1184-76-5 Molecular Formula: CF2I2 Molecular Weight (g/mol): 303.82 Synonym: Difluorodiiodomethane IUPAC Name: difluoro(diiodo)methane SMILES: FC(F)(I)I

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CAS	1184-76-5
Molecular Weight (g/mol)	303.82
SMILES	FC(F)(I)I
Synonym	Difluorodiiodomethane
IUPAC Name	difluoro(diiodo)methane
Molecular Formula	CF2I2

Diiodochloromethane, TRC

CAS: 638-73-3 Molecular Formula: C H Cl I2 Molecular Weight (g/mol): 302.28 Synonym: Chlorodiiodomethane,Diiodochloromethane,Methane, chlorodiiodo- (6CI,9CI) IUPAC Name: chloro(diiodo)methane SMILES: ClC(I)I

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CAS	638-73-3
Molecular Weight (g/mol)	302.28
SMILES	ClC(I)I
Synonym	Chlorodiiodomethane,Diiodochloromethane,Methane, chlorodiiodo- (6CI,9CI)
IUPAC Name	chloro(diiodo)methane
Molecular Formula	C H Cl I2

Alkyl Halides

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