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Organochlorides

Organic compounds that contain one or more chlorine atoms.
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Keyword Search:
1 – 15 of 319 results
1

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

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
2

Tetrachloroethylene, ≥99.5%, Honeywell™

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: tetrachloroethene SMILES: ClC(Cl)=C(Cl)Cl

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 tetrachloroethene
InChI Key CYTYCFOTNPOANT-UHFFFAOYSA-N
Molecular Formula C2Cl4
3

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

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
4

Dimethylthiocarbamoyl chloride, 95%

CAS: 16420-13-6 Molecular Formula: C3H6ClNS Molecular Weight (g/mol): 123.60 MDL Number: MFCD00004919 InChI Key: PHWISQNXPLXQRU-UHFFFAOYSA-N Synonym: dimethylthiocarbamoyl chloride,carbamothioic chloride, dimethyl,chloromethanethioyl dimethylamine,n,n-dimethylthiocarbamoyl chloride,n,n-dimethylcarbamothioic chloride,dimethylthiocarbamoylchloride,carbamoyl chloride, dimethylthio,carbamothioic chloride, n,n-dimethyl,dimethylthiocarbamyl chloride,dimethylthiocarbamic acid chloride PubChem CID: 27871 SMILES: CN(C)C(Cl)=S

PubChem CID 27871
CAS 16420-13-6
Molecular Weight (g/mol) 123.60
MDL Number MFCD00004919
SMILES CN(C)C(Cl)=S
Synonym dimethylthiocarbamoyl chloride,carbamothioic chloride, dimethyl,chloromethanethioyl dimethylamine,n,n-dimethylthiocarbamoyl chloride,n,n-dimethylcarbamothioic chloride,dimethylthiocarbamoylchloride,carbamoyl chloride, dimethylthio,carbamothioic chloride, n,n-dimethyl,dimethylthiocarbamyl chloride,dimethylthiocarbamic acid chloride
InChI Key PHWISQNXPLXQRU-UHFFFAOYSA-N
Molecular Formula C3H6ClNS
5

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

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
6

Chloromethyl chlorosulfate, 97%

CAS: 49715-04-0 MDL Number: MFCD00041547 InChI Key: PJBIHXWYDMFGCV-UHFFFAOYSA-N Synonym: chloromethyl chlorosulfate,chloromethyl chlorosulphate,chloromethylchlorosulfate,chloromethyl chlorosulfonate,chloromethyl chloranesulfonate,unii-n615783bnf,chloromethyl sulfochloridate,chlorosulfuric acid, chloromethyl ester,chloro chlorosulfonyloxy methane,chlorosulfuric acid chloromethyl ester PubChem CID: 2733556 IUPAC Name: chloro(chlorosulfonyloxy)methane SMILES: C(OS(=O)(=O)Cl)Cl

PubChem CID 2733556
CAS 49715-04-0
MDL Number MFCD00041547
SMILES C(OS(=O)(=O)Cl)Cl
Synonym chloromethyl chlorosulfate,chloromethyl chlorosulphate,chloromethylchlorosulfate,chloromethyl chlorosulfonate,chloromethyl chloranesulfonate,unii-n615783bnf,chloromethyl sulfochloridate,chlorosulfuric acid, chloromethyl ester,chloro chlorosulfonyloxy methane,chlorosulfuric acid chloromethyl ester
IUPAC Name chloro(chlorosulfonyloxy)methane
InChI Key PJBIHXWYDMFGCV-UHFFFAOYSA-N
7

1-Chloroadamantane, 98%

CAS: 935-56-8 Molecular Formula: C10H15Cl Molecular Weight (g/mol): 170.68 MDL Number: MFCD00075627 InChI Key: OZNXTQSXSHODFR-UHFFFAOYSA-N Synonym: 1-adamantyl chloride,adamantyl chloride,3-chloroadamantane,adamantane, 1-chloro,tricyclo 3.3.1.13,7 decane, 1-chloro,1-chlorotricyclo 3.3.1.13,7 decane,3r,5s,7s-1-chloroadamantane,1-chlorotricyclo 3.3.1.1∼3,7∼ decane PubChem CID: 64154 IUPAC Name: 1-chloroadamantane SMILES: ClC12CC3CC(CC(C3)C1)C2

PubChem CID 64154
CAS 935-56-8
Molecular Weight (g/mol) 170.68
MDL Number MFCD00075627
SMILES ClC12CC3CC(CC(C3)C1)C2
Synonym 1-adamantyl chloride,adamantyl chloride,3-chloroadamantane,adamantane, 1-chloro,tricyclo 3.3.1.13,7 decane, 1-chloro,1-chlorotricyclo 3.3.1.13,7 decane,3r,5s,7s-1-chloroadamantane,1-chlorotricyclo 3.3.1.1∼3,7∼ decane
IUPAC Name 1-chloroadamantane
InChI Key OZNXTQSXSHODFR-UHFFFAOYSA-N
Molecular Formula C10H15Cl
8

Chloroform, ≥99.5%, Honeywell™

CAS: 67-66-3 Molecular Formula: CHCl3 Molecular Weight (g/mol): 119.37 MDL Number: MFCD00000826 InChI Key: HEDRZPFGACZZDS-UHFFFAOYSA-N Synonym: trichloromethane,formyl trichloride,methane, trichloro,trichloroform,methane trichloride,methenyl trichloride,methyl trichloride,trichlormethan,chloroforme,cloroformio PubChem CID: 6212 ChEBI: CHEBI:35255 SMILES: ClC(Cl)Cl

PubChem CID 6212
CAS 67-66-3
Molecular Weight (g/mol) 119.37
ChEBI CHEBI:35255
MDL Number MFCD00000826
SMILES ClC(Cl)Cl
Synonym trichloromethane,formyl trichloride,methane, trichloro,trichloroform,methane trichloride,methenyl trichloride,methyl trichloride,trichlormethan,chloroforme,cloroformio
InChI Key HEDRZPFGACZZDS-UHFFFAOYSA-N
Molecular Formula CHCl3
9

5-chloro-2-pentanone, 90%

CAS: 5891-21-4 Molecular Formula: C5H9ClO Molecular Weight (g/mol): 120.58 MDL Number: MFCD00001008 InChI Key: XVRIEWDDMODMGA-UHFFFAOYSA-N Synonym: 5-chloro-2-pentanone,2-pentanone, 5-chloro,1-chloro-4-pentanone,3-chloropropyl methyl ketone,2-pentanone 5-chloro,1-chloro-4-oxopentane,pubchem17207,3-acetylpropyl chloride,5-chloro-pentan-2-one,5-chloranylpentan-2-one PubChem CID: 79993 IUPAC Name: 5-chloropentan-2-one SMILES: CC(=O)CCCCl

PubChem CID 79993
CAS 5891-21-4
Molecular Weight (g/mol) 120.58
MDL Number MFCD00001008
SMILES CC(=O)CCCCl
Synonym 5-chloro-2-pentanone,2-pentanone, 5-chloro,1-chloro-4-pentanone,3-chloropropyl methyl ketone,2-pentanone 5-chloro,1-chloro-4-oxopentane,pubchem17207,3-acetylpropyl chloride,5-chloro-pentan-2-one,5-chloranylpentan-2-one
IUPAC Name 5-chloropentan-2-one
InChI Key XVRIEWDDMODMGA-UHFFFAOYSA-N
Molecular Formula C5H9ClO
10

N-Methoxy-N-methylcarbamoyl chloride, 95%, Thermo Scientific Chemicals

CAS: 30289-28-2 Molecular Formula: C3H6ClNO2 Molecular Weight (g/mol): 123.54 MDL Number: MFCD06658962 InChI Key: SHQJHXLWZDMQEJ-UHFFFAOYSA-N Synonym: acmc-209he9,methylmethoxycarbamoyl chloride,methoxy methyl carbamic chloride,n-methoxy-n-methylcarbamic chloride,n-methoxy-n-methylcarbamyl chloride,n-methyl-n-methoxycarbamyl chloride,carbamic chloride,n-methoxy-n-methyl,n-methoxy-n-methylcarbamic acid chloride PubChem CID: 2734926 IUPAC Name: N-methoxy-N-methylcarbamoyl chloride SMILES: CON(C)C(Cl)=O

PubChem CID 2734926
CAS 30289-28-2
Molecular Weight (g/mol) 123.54
MDL Number MFCD06658962
SMILES CON(C)C(Cl)=O
Synonym acmc-209he9,methylmethoxycarbamoyl chloride,methoxy methyl carbamic chloride,n-methoxy-n-methylcarbamic chloride,n-methoxy-n-methylcarbamyl chloride,n-methyl-n-methoxycarbamyl chloride,carbamic chloride,n-methoxy-n-methyl,n-methoxy-n-methylcarbamic acid chloride
IUPAC Name N-methoxy-N-methylcarbamoyl chloride
InChI Key SHQJHXLWZDMQEJ-UHFFFAOYSA-N
Molecular Formula C3H6ClNO2
11

1-chlorobutane, Sequenation Grade

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

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
12

1-Chloro-1-phenylethane, 97%

CAS: 672-65-1 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00018870 InChI Key: GTLWADFFABIGAE-UHFFFAOYSA-N Synonym: 1-chloroethyl benzene,1-chloro-1-phenylethane,1-phenylethyl chloride,alpha-phenylethyl chloride,alpha-methylbenzyl chloride,benzene, 1-chloroethyl,1-phenyl-ethylchloride,ccris 1778,.alpha.-methylbenzyl chloride,rs-phenethyl chloride PubChem CID: 12648 IUPAC Name: 1-chloroethylbenzene SMILES: CC(C1=CC=CC=C1)Cl

PubChem CID 12648
CAS 672-65-1
Molecular Weight (g/mol) 140.61
MDL Number MFCD00018870
SMILES CC(C1=CC=CC=C1)Cl
Synonym 1-chloroethyl benzene,1-chloro-1-phenylethane,1-phenylethyl chloride,alpha-phenylethyl chloride,alpha-methylbenzyl chloride,benzene, 1-chloroethyl,1-phenyl-ethylchloride,ccris 1778,.alpha.-methylbenzyl chloride,rs-phenethyl chloride
IUPAC Name 1-chloroethylbenzene
InChI Key GTLWADFFABIGAE-UHFFFAOYSA-N
Molecular Formula C8H9Cl
13

5-Chlorovaleronitrile, 97%, Thermo Scientific™

CAS: 6280-87-1 Molecular Formula: C5H8ClN Molecular Weight (g/mol): 117.58 MDL Number: MFCD00001977 InChI Key: JSAWFGSXRPCFSW-UHFFFAOYSA-N Synonym: 5-chlorovaleronitrile,pentanenitrile, 5-chloro,5-chloro-n-valeronitrile,valeronitrile, 5-chloro,5-chloro valeronitrile,.delta.-chlorovaleronitrile,snxhfhaiuzjp@,5-chlorovaieronitrile,4-chlorobutyl cyanide,delta-chlorovaleronitrile PubChem CID: 80474 IUPAC Name: 5-chloropentanenitrile SMILES: ClCCCCC#N

PubChem CID 80474
CAS 6280-87-1
Molecular Weight (g/mol) 117.58
MDL Number MFCD00001977
SMILES ClCCCCC#N
Synonym 5-chlorovaleronitrile,pentanenitrile, 5-chloro,5-chloro-n-valeronitrile,valeronitrile, 5-chloro,5-chloro valeronitrile,.delta.-chlorovaleronitrile,snxhfhaiuzjp@,5-chlorovaieronitrile,4-chlorobutyl cyanide,delta-chlorovaleronitrile
IUPAC Name 5-chloropentanenitrile
InChI Key JSAWFGSXRPCFSW-UHFFFAOYSA-N
Molecular Formula C5H8ClN
14

Benzyl chloroformate, 3M (50 wt%) solution in toluene

CAS: 501-53-1 | C8H7ClO2 | 170.6 g/mol

Linear Formula C6H5CH2OOCCl
Molecular Weight (g/mol) 170.6
CAS Min % 47.0
InChI Key HSDAJNMJOMSNEV-UHFFFAOYSA-N
Density 1.0100g/mL
PubChem CID 10387
Name Note 50 wt. % Solution in Toluene
Percent Purity 45 to 53 wt%
Fieser 01,109; 02,59; 15,22
Formula Weight 170.6
CAS Max % 55.0
Physical Form Solution
Chemical Name or Material Benzyl chloroformate
SMILES C1=CC=C(C=C1)COC(=O)Cl
Merck Index 15, 1801
CAS 100-44-7
Health Hazard 3 GHS P Statement
IF SWALLOWED: rinse mouth. Do NOT induce vomiting. Wear eye protection/face protection. IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Immediately call a POISON CENTER or doctor/physician. Keep away from heat/sparks/open flames/hot surfaces. - No smoking. Do not breathe dust/fume/gas/mist/vapors/spray. IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician. Avoid release to the environment.
MDL Number MFCD00000640
Health Hazard 2 GHS H Statement
May cause drowsiness or dizziness. May cause cancer. May be fatal if swallowed and enters airways. May cause damage to organs through prolonged or repeated exposure. Very toxic to aquatic life with long lasting effects. Causes severe skin burns and eye damage. Suspected of damaging the unborn child. Highly flammable liquid and vapor.
Solubility Information Solubility in water: decomposes
Packaging Glass bottle
Flash Point 7°C
Health Hazard 1 GHS Signal Word: Danger
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
TSCA TSCA
IUPAC Name benzyl carbonochloridate
Beilstein 06, 437
Molecular Formula C8H7ClO2
EINECS Number 207-925-0
Specific Gravity 1.01
15

Trichloroacetonitrile, 98%

CAS: 545-06-2 Molecular Formula: C2Cl3N Molecular Weight (g/mol): 144.39 InChI Key: DRUIESSIVFYOMK-UHFFFAOYSA-N Synonym: trichloroacetonitrile,acetonitrile, trichloro,tritox,cyanotrichloromethane,trichloromethyl cyanide,trichloroethanenitrile,trichlouracetonitril,trichlor-acetonitrile,trichloromethylnitrile,nitrile trichloracetique PubChem CID: 11011 ChEBI: CHEBI:82541 IUPAC Name: 2,2,2-trichloroacetonitrile SMILES: C(#N)C(Cl)(Cl)Cl

PubChem CID 11011
CAS 545-06-2
Molecular Weight (g/mol) 144.39
ChEBI CHEBI:82541
SMILES C(#N)C(Cl)(Cl)Cl
Synonym trichloroacetonitrile,acetonitrile, trichloro,tritox,cyanotrichloromethane,trichloromethyl cyanide,trichloroethanenitrile,trichlouracetonitril,trichlor-acetonitrile,trichloromethylnitrile,nitrile trichloracetique
IUPAC Name 2,2,2-trichloroacetonitrile
InChI Key DRUIESSIVFYOMK-UHFFFAOYSA-N
Molecular Formula C2Cl3N