Organochlorides

Organic compounds that contain one or more chlorine atoms.

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n-Butyl Chloride (HPLC), Fisher Chemical™

CAS: 109-69-3 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.57 InChI Key: VFWCMGCRMGJXDK-UHFFFAOYSA-N Synonym: butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane PubChem CID: 8005 IUPAC Name: 1-chlorobutane SMILES: CCCCCl

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PubChem CID	8005
CAS	109-69-3
Molecular Weight (g/mol)	92.57
SMILES	CCCCCl
Synonym	butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane
IUPAC Name	1-chlorobutane
InChI Key	VFWCMGCRMGJXDK-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

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1,2-Dibromotetrachloroethane, 97%

CAS: 630-25-1 Molecular Formula: C₂Br₂Cl₄ Molecular Weight (g/mol): 325.63 MDL Number: MFCD00000780 InChI Key: WJUKOGPNGRUXMG-UHFFFAOYSA-N Synonym: 1,2-dibromotetrachloroethane,dbtce,sym-dibromotetrachloroethane,ethane, 1,2-dibromo-1,1,2,2-tetrachloro,unii-0sgg217efr,0sgg217efr,1,2-dibrom-1,1,2,2-tetrachlorethan,brccl2ccl2br,1,2-dibromotetrachloroethan,1,2-dibrom-tetrachlorethane PubChem CID: 69426 IUPAC Name: 1,2-dibromo-1,1,2,2-tetrachloroethane SMILES: C(C(Cl)(Cl)Br)(Cl)(Cl)Br

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PubChem CID	69426
CAS	630-25-1
Molecular Weight (g/mol)	325.63
MDL Number	MFCD00000780
SMILES	C(C(Cl)(Cl)Br)(Cl)(Cl)Br
Synonym	1,2-dibromotetrachloroethane,dbtce,sym-dibromotetrachloroethane,ethane, 1,2-dibromo-1,1,2,2-tetrachloro,unii-0sgg217efr,0sgg217efr,1,2-dibrom-1,1,2,2-tetrachlorethan,brccl2ccl2br,1,2-dibromotetrachloroethan,1,2-dibrom-tetrachlorethane
IUPAC Name	1,2-dibromo-1,1,2,2-tetrachloroethane
InChI Key	WJUKOGPNGRUXMG-UHFFFAOYSA-N
Molecular Formula	C₂Br₂Cl₄

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trans-1,2-Dichloroethylene, 99+%, stabilized

CAS: 156-60-5 Molecular Formula: C2H2Cl2 Molecular Weight (g/mol): 96.94 MDL Number: MFCD00062942 InChI Key: KFUSEUYYWQURPO-OWOJBTEDSA-N Synonym: trans-1,2-dichloroethylene,trans-1,2-dichloroethene,e-1,2-dichloroethene,e-1,2-dichloroethylene,trans-dichloroethylene,trans-acetylene dichloride,1,2-trans-dichloroethylene,acetylene dichloride,ethene, 1,2-dichloro-, 1e,dioform PubChem CID: 638186 ChEBI: CHEBI:29027 IUPAC Name: (E)-1,2-dichloroethene SMILES: Cl\C=C\Cl

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PubChem CID	638186
CAS	156-60-5
Molecular Weight (g/mol)	96.94
ChEBI	CHEBI:29027
MDL Number	MFCD00062942
SMILES	Cl\C=C\Cl
Synonym	trans-1,2-dichloroethylene,trans-1,2-dichloroethene,e-1,2-dichloroethene,e-1,2-dichloroethylene,trans-dichloroethylene,trans-acetylene dichloride,1,2-trans-dichloroethylene,acetylene dichloride,ethene, 1,2-dichloro-, 1e,dioform
IUPAC Name	(E)-1,2-dichloroethene
InChI Key	KFUSEUYYWQURPO-OWOJBTEDSA-N
Molecular Formula	C2H2Cl2

Tetrachloroethylene, Ultrapure, Spectrophotometric Grade, 99+%

CAS: 127-18-4 Molecular Formula: C2Cl4 Molecular Weight (g/mol): 165.82 MDL Number: MFCD00000834 InChI Key: CYTYCFOTNPOANT-UHFFFAOYSA-N Synonym: tetrachloroethylene,tetrachloroethene,perchloroethylene,perchlorethylene,perc,ethene, tetrachloro,tetrachlorethylene,ethylene tetrachloride,carbon dichloride,ankilostin PubChem CID: 31373 ChEBI: CHEBI:17300 IUPAC Name: 1,1,2,2-tetrachloroethene SMILES: ClC(Cl)=C(Cl)Cl

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PubChem CID	31373
CAS	127-18-4
Molecular Weight (g/mol)	165.82
ChEBI	CHEBI:17300
MDL Number	MFCD00000834
SMILES	ClC(Cl)=C(Cl)Cl
Synonym	tetrachloroethylene,tetrachloroethene,perchloroethylene,perchlorethylene,perc,ethene, tetrachloro,tetrachlorethylene,ethylene tetrachloride,carbon dichloride,ankilostin
IUPAC Name	1,1,2,2-tetrachloroethene
InChI Key	CYTYCFOTNPOANT-UHFFFAOYSA-N
Molecular Formula	C2Cl4

Trichloroethylene, 98%

CAS: 79-01-6 Molecular Formula: C2HCl3 Molecular Weight (g/mol): 131.38 MDL Number: MFCD00000838 InChI Key: XSTXAVWGXDQKEL-UHFFFAOYSA-N Synonym: trichloroethylene,trichloroethene,ethene, trichloro,trilene,trichlorethylene,ethinyl trichloride,ethylene trichloride,acetylene trichloride,chlorilen,narcogen PubChem CID: 6575 ChEBI: CHEBI:16602 IUPAC Name: 1,1,2-trichloroethene SMILES: C(=C(Cl)Cl)Cl

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PubChem CID	6575
CAS	79-01-6
Molecular Weight (g/mol)	131.38
ChEBI	CHEBI:16602
MDL Number	MFCD00000838
SMILES	C(=C(Cl)Cl)Cl
Synonym	trichloroethylene,trichloroethene,ethene, trichloro,trilene,trichlorethylene,ethinyl trichloride,ethylene trichloride,acetylene trichloride,chlorilen,narcogen
IUPAC Name	1,1,2-trichloroethene
InChI Key	XSTXAVWGXDQKEL-UHFFFAOYSA-N
Molecular Formula	C2HCl3

1-Chlorobutane, HPLC Grade, 99.5+%

CAS: 109-69-3 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.57 MDL Number: MFCD00001009 InChI Key: VFWCMGCRMGJXDK-UHFFFAOYSA-N Synonym: butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane PubChem CID: 8005 IUPAC Name: 1-chlorobutane SMILES: CCCCCl

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Specifications

PubChem CID	8005
CAS	109-69-3
Molecular Weight (g/mol)	92.57
MDL Number	MFCD00001009
SMILES	CCCCCl
Synonym	butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane
IUPAC Name	1-chlorobutane
InChI Key	VFWCMGCRMGJXDK-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

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3-Chloro-2-methylpropene, 98%

CAS: 563-47-3 Molecular Formula: C4H7Cl Molecular Weight (g/mol): 90.55 MDL Number: MFCD00000953 InChI Key: OHXAOPZTJOUYKM-UHFFFAOYSA-N Synonym: 3-chloro-2-methylpropene,methallyl chloride,3-chloro-2-methyl-1-propene,1-propene, 3-chloro-2-methyl,2-methylallyl chloride,isobutenyl chloride,2-methyl-2-propenyl chloride,beta-methallyl chloride,propene, 3-chloro-2-methyl,cloruro di metallile PubChem CID: 11241 ChEBI: CHEBI:82419 IUPAC Name: 3-chloro-2-methylprop-1-ene SMILES: CC(=C)CCl

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PubChem CID	11241
CAS	563-47-3
Molecular Weight (g/mol)	90.55
ChEBI	CHEBI:82419
MDL Number	MFCD00000953
SMILES	CC(=C)CCl
Synonym	3-chloro-2-methylpropene,methallyl chloride,3-chloro-2-methyl-1-propene,1-propene, 3-chloro-2-methyl,2-methylallyl chloride,isobutenyl chloride,2-methyl-2-propenyl chloride,beta-methallyl chloride,propene, 3-chloro-2-methyl,cloruro di metallile
IUPAC Name	3-chloro-2-methylprop-1-ene
InChI Key	OHXAOPZTJOUYKM-UHFFFAOYSA-N
Molecular Formula	C4H7Cl

PubChem CID	6575
CAS	79-01-6
Molecular Weight (g/mol)	131.38
ChEBI	CHEBI:16602
MDL Number	MFCD00000838
SMILES	C(=C(Cl)Cl)Cl
Synonym	trichloroethylene,trichloroethene,ethene, trichloro,trilene,trichlorethylene,ethinyl trichloride,ethylene trichloride,acetylene trichloride,chlorilen,narcogen
IUPAC Name	1,1,2-trichloroethene
InChI Key	XSTXAVWGXDQKEL-UHFFFAOYSA-N
Molecular Formula	C2HCl3

Benzyl Chloroformate 96.0+%, TCI America™

CAS: 501-53-1 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00000640 InChI Key: HSDAJNMJOMSNEV-UHFFFAOYSA-N Synonym: benzyl chloroformate,carbobenzoxy chloride,benzyl chlorocarbonate,cbz chloride,benzyloxycarbonyl chloride,carbobenzyloxy chloride,carbonochloridic acid, phenylmethyl ester,benzylcarbonyl chloride,cbz-cl,chloroformic acid, benzyl ester PubChem CID: 10387 IUPAC Name: benzyl carbonochloridate SMILES: C1=CC=C(C=C1)COC(=O)Cl

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PubChem CID	10387
CAS	501-53-1
Molecular Weight (g/mol)	170.592
MDL Number	MFCD00000640
SMILES	C1=CC=C(C=C1)COC(=O)Cl
Synonym	benzyl chloroformate,carbobenzoxy chloride,benzyl chlorocarbonate,cbz chloride,benzyloxycarbonyl chloride,carbobenzyloxy chloride,carbonochloridic acid, phenylmethyl ester,benzylcarbonyl chloride,cbz-cl,chloroformic acid, benzyl ester
IUPAC Name	benzyl carbonochloridate
InChI Key	HSDAJNMJOMSNEV-UHFFFAOYSA-N
Molecular Formula	C8H7ClO2

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6-Chloro-2-hexanone, 98%

CAS: 10226-30-9 Molecular Formula: C6H11ClO Molecular Weight (g/mol): 134.603 MDL Number: MFCD00191625 InChI Key: CMDIDTNMHQUVPE-UHFFFAOYSA-N Synonym: 6-chloro-2-hexanone,1-chloro-5-hexanone,2-hexanone, 6-chloro,1-chlorohexan-5-one,1-chlorohexane-5-one,4-chlorobutyl methyl ketone,chlorohexanone,1-chloro-hexan-5-one,6-chloro-hexan-2-one,6-chloranylhexan-2-one PubChem CID: 82468 IUPAC Name: 6-chlorohexan-2-one SMILES: CC(=O)CCCCCl

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PubChem CID	82468
CAS	10226-30-9
Molecular Weight (g/mol)	134.603
MDL Number	MFCD00191625
SMILES	CC(=O)CCCCCl
Synonym	6-chloro-2-hexanone,1-chloro-5-hexanone,2-hexanone, 6-chloro,1-chlorohexan-5-one,1-chlorohexane-5-one,4-chlorobutyl methyl ketone,chlorohexanone,1-chloro-hexan-5-one,6-chloro-hexan-2-one,6-chloranylhexan-2-one
IUPAC Name	6-chlorohexan-2-one
InChI Key	CMDIDTNMHQUVPE-UHFFFAOYSA-N
Molecular Formula	C6H11ClO

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5-Chloromethyl-1H-tetrazole, 95%

CAS: 55408-11-2 Molecular Formula: C2H3ClN4 Molecular Weight (g/mol): 118.52 MDL Number: MFCD00512845 InChI Key: AGWSISOYPHROLN-UHFFFAOYSA-N Synonym: 5-chloromethyl-1h-tetrazole,5-chloromethyl-1h-1,2,3,4-tetrazole,5-chloromethyl-2h-tetrazole,1h-tetrazole, 5-chloromethyl,5-chloromethyl-1 2 h-tetrazole,5-chloromethyl-2h-1,2,3,4-tetrazole,chloromethyltetrazole,pubchem9133,5-chloromethyltetrazole PubChem CID: 12205080 IUPAC Name: 5-(chloromethyl)-2H-tetrazole SMILES: ClCC1=NNN=N1

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PubChem CID	12205080
CAS	55408-11-2
Molecular Weight (g/mol)	118.52
MDL Number	MFCD00512845
SMILES	ClCC1=NNN=N1
Synonym	5-chloromethyl-1h-tetrazole,5-chloromethyl-1h-1,2,3,4-tetrazole,5-chloromethyl-2h-tetrazole,1h-tetrazole, 5-chloromethyl,5-chloromethyl-1 2 h-tetrazole,5-chloromethyl-2h-1,2,3,4-tetrazole,chloromethyltetrazole,pubchem9133,5-chloromethyltetrazole
IUPAC Name	5-(chloromethyl)-2H-tetrazole
InChI Key	AGWSISOYPHROLN-UHFFFAOYSA-N
Molecular Formula	C2H3ClN4

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1-Bromo-1-chloroethane, 98%

CAS: 593-96-4 Molecular Formula: C2H4BrCl Molecular Weight (g/mol): 143.408 MDL Number: MFCD00018842 InChI Key: QMSVNDSDEZTYAS-UHFFFAOYSA-N Synonym: ch3chclbr,ethane, 1-bromo-1-chloro,bromochloroethane,ethane, bromochloro,bromochloroethan,chlorobromoethane,bromo-chloroethane,1-bromochoroethane,bromo chloro ethane,acmc-20aoxm PubChem CID: 11654 IUPAC Name: 1-bromo-1-chloroethane SMILES: CC(Cl)Br

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PubChem CID	11654
CAS	593-96-4
Molecular Weight (g/mol)	143.408
MDL Number	MFCD00018842
SMILES	CC(Cl)Br
Synonym	ch3chclbr,ethane, 1-bromo-1-chloro,bromochloroethane,ethane, bromochloro,bromochloroethan,chlorobromoethane,bromo-chloroethane,1-bromochoroethane,bromo chloro ethane,acmc-20aoxm
IUPAC Name	1-bromo-1-chloroethane
InChI Key	QMSVNDSDEZTYAS-UHFFFAOYSA-N
Molecular Formula	C2H4BrCl

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2,3-Dichloro-1-propene, 98%

CAS: 78-88-6 Molecular Formula: C3H4Cl2 Molecular Weight (g/mol): 110.965 MDL Number: MFCD00000943 InChI Key: FALCMQXTWHPRIH-UHFFFAOYSA-N Synonym: 2,3-dichloropropene,2,3-dichloro-1-propene,2-chloroallyl chloride,2,3-dichloropropylene,1-propene, 2,3-dichloro,propene, 2,3-dichloro,1,2-dichloro-2-propene,propylene, 2,3-dichloro,ccris 956,unii-370tnk5i41 PubChem CID: 6565 IUPAC Name: 2,3-dichloroprop-1-ene SMILES: C=C(CCl)Cl

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PubChem CID	6565
CAS	78-88-6
Molecular Weight (g/mol)	110.965
MDL Number	MFCD00000943
SMILES	C=C(CCl)Cl
Synonym	2,3-dichloropropene,2,3-dichloro-1-propene,2-chloroallyl chloride,2,3-dichloropropylene,1-propene, 2,3-dichloro,propene, 2,3-dichloro,1,2-dichloro-2-propene,propylene, 2,3-dichloro,ccris 956,unii-370tnk5i41
IUPAC Name	2,3-dichloroprop-1-ene
InChI Key	FALCMQXTWHPRIH-UHFFFAOYSA-N
Molecular Formula	C3H4Cl2

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1,2-Dichloropropane, 98%

CAS: 78-87-5 Molecular Formula: C3H6Cl2 Molecular Weight (g/mol): 112.98 MDL Number: MFCD00000868 InChI Key: KNKRKFALVUDBJE-UHFFFAOYNA-N Synonym: propylene dichloride,propane, 1,2-dichloro,propylene chloride,dwuchloropropan,bichlorure de propylene,rcra waste number u083,caswell no. 324,dwuchloropropan polish,alpha,beta-dichloropropane,ccris 951 PubChem CID: 6564 ChEBI: CHEBI:82163 IUPAC Name: 1,2-dichloropropane SMILES: CC(Cl)CCl

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PubChem CID	6564
CAS	78-87-5
Molecular Weight (g/mol)	112.98
ChEBI	CHEBI:82163
MDL Number	MFCD00000868
SMILES	CC(Cl)CCl
Synonym	propylene dichloride,propane, 1,2-dichloro,propylene chloride,dwuchloropropan,bichlorure de propylene,rcra waste number u083,caswell no. 324,dwuchloropropan polish,alpha,beta-dichloropropane,ccris 951
IUPAC Name	1,2-dichloropropane
InChI Key	KNKRKFALVUDBJE-UHFFFAOYNA-N
Molecular Formula	C3H6Cl2

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1,2,3-Trichloropropane, 98+%

CAS: 96-18-4 Molecular Formula: C3H5Cl3 Molecular Weight (g/mol): 147.42 MDL Number: MFCD00000946 InChI Key: CFXQEHVMCRXUSD-UHFFFAOYSA-N Synonym: trichlorohydrin,allyl trichloride,propane, 1,2,3-trichloro,glycerol trichlorohydrin,glyceryl trichlorohydrin,unii-3mj7qck0z0,ccris 5874,3mj7qck0z0,dsstox_cid_1390,dsstox_rid_76132 PubChem CID: 7285 ChEBI: CHEBI:34036 IUPAC Name: 1,2,3-trichloropropane SMILES: ClCC(Cl)CCl

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PubChem CID	7285
CAS	96-18-4
Molecular Weight (g/mol)	147.42
ChEBI	CHEBI:34036
MDL Number	MFCD00000946
SMILES	ClCC(Cl)CCl
Synonym	trichlorohydrin,allyl trichloride,propane, 1,2,3-trichloro,glycerol trichlorohydrin,glyceryl trichlorohydrin,unii-3mj7qck0z0,ccris 5874,3mj7qck0z0,dsstox_cid_1390,dsstox_rid_76132
IUPAC Name	1,2,3-trichloropropane
InChI Key	CFXQEHVMCRXUSD-UHFFFAOYSA-N
Molecular Formula	C3H5Cl3

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