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Organochlorides

Organic compounds that contain one or more chlorine atoms.
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Keyword Search:
1 – 15 of 315 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

3-Chloropropionitrile, 98%

CAS: 542-76-7 Molecular Formula: C3H4ClN Molecular Weight (g/mol): 89.52 MDL Number: MFCD00001952 InChI Key: GNHMRTZZNHZDDM-UHFFFAOYSA-N Synonym: 3-chloropropionitrile,propanenitrile, 3-chloro,3-chloropropiononitrile,1-chloro-2-cyanoethane,3-chloropropanonitrile,3-chlorpropannitril,propionitrile, 3-chloro,beta-chloropropionitrile,usaf a-8798,rcra waste number p027 PubChem CID: 10963 IUPAC Name: 3-chloropropanenitrile SMILES: ClCCC#N

PubChem CID 10963
CAS 542-76-7
Molecular Weight (g/mol) 89.52
MDL Number MFCD00001952
SMILES ClCCC#N
Synonym 3-chloropropionitrile,propanenitrile, 3-chloro,3-chloropropiononitrile,1-chloro-2-cyanoethane,3-chloropropanonitrile,3-chlorpropannitril,propionitrile, 3-chloro,beta-chloropropionitrile,usaf a-8798,rcra waste number p027
IUPAC Name 3-chloropropanenitrile
InChI Key GNHMRTZZNHZDDM-UHFFFAOYSA-N
Molecular Formula C3H4ClN
3

1,4-Dichloro-2-butyne, 99%

CAS: 821-10-3 Molecular Formula: C4H4Cl2 Molecular Weight (g/mol): 122.98 MDL Number: MFCD00000981 InChI Key: RCHDLEVSZBOHOS-UHFFFAOYSA-N Synonym: 1,4-dichloro-2-butyne,2-butyne, 1,4-dichloro,1,4-dichlorobutyne,2-butyne,4-dichloro,1,4 dichloro-2-butyne,1,4-dichloro-2-butine,1,4-dichloro-but-2-yne,acmc-209pn5,wln: g2uu2g,4-01-00-00973 beilstein handbook reference PubChem CID: 13182 IUPAC Name: 1,4-dichlorobut-2-yne SMILES: ClCC#CCCl

PubChem CID 13182
CAS 821-10-3
Molecular Weight (g/mol) 122.98
MDL Number MFCD00000981
SMILES ClCC#CCCl
Synonym 1,4-dichloro-2-butyne,2-butyne, 1,4-dichloro,1,4-dichlorobutyne,2-butyne,4-dichloro,1,4 dichloro-2-butyne,1,4-dichloro-2-butine,1,4-dichloro-but-2-yne,acmc-209pn5,wln: g2uu2g,4-01-00-00973 beilstein handbook reference
IUPAC Name 1,4-dichlorobut-2-yne
InChI Key RCHDLEVSZBOHOS-UHFFFAOYSA-N
Molecular Formula C4H4Cl2
4

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

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
5

2-Chlorobutane, 99+%

CAS: 78-86-4 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.57 MDL Number: MFCD00000871 InChI Key: BSPCSKHALVHRSR-UHFFFAOYSA-N Synonym: sec-butyl chloride,butane, 2-chloro,1-methylpropyl chloride,2-chloro-butane,ccris 9391,alkanes, c11-14, 2-chloro,sec.-butyl chloride,sjphadilup@,sec-c4h9cl,acmc-209pfl PubChem CID: 6563 IUPAC Name: 2-chlorobutane SMILES: CCC(C)Cl

PubChem CID 6563
CAS 78-86-4
Molecular Weight (g/mol) 92.57
MDL Number MFCD00000871
SMILES CCC(C)Cl
Synonym sec-butyl chloride,butane, 2-chloro,1-methylpropyl chloride,2-chloro-butane,ccris 9391,alkanes, c11-14, 2-chloro,sec.-butyl chloride,sjphadilup@,sec-c4h9cl,acmc-209pfl
IUPAC Name 2-chlorobutane
InChI Key BSPCSKHALVHRSR-UHFFFAOYSA-N
Molecular Formula C4H9Cl
6

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
7

1,10-Dichlorodecane, 98%

CAS: 2162-98-3 Molecular Formula: C10H20Cl2 Molecular Weight (g/mol): 211.17 MDL Number: MFCD00000957 InChI Key: RBBNTRDPSVZESY-UHFFFAOYSA-N Synonym: decane, 1,10-dichloro,decamethylene dichloride,decane,10-dichloro,1, 10-dichlorodecane,acmc-1cbxv,ksc202q6p,1,10-dichlorodecane,1,10-decamethylene dichloride PubChem CID: 75101 IUPAC Name: 1,10-dichlorodecane SMILES: ClCCCCCCCCCCCl

PubChem CID 75101
CAS 2162-98-3
Molecular Weight (g/mol) 211.17
MDL Number MFCD00000957
SMILES ClCCCCCCCCCCCl
Synonym decane, 1,10-dichloro,decamethylene dichloride,decane,10-dichloro,1, 10-dichlorodecane,acmc-1cbxv,ksc202q6p,1,10-dichlorodecane,1,10-decamethylene dichloride
IUPAC Name 1,10-dichlorodecane
InChI Key RBBNTRDPSVZESY-UHFFFAOYSA-N
Molecular Formula C10H20Cl2
8

4-Chlorobutyronitrile, 97%

CAS: 628-20-6 Molecular Formula: C4H6ClN Molecular Weight (g/mol): 103.55 MDL Number: MFCD00001972 InChI Key: ZFCFBWSVQWGOJJ-UHFFFAOYSA-N Synonym: 4-chlorobutyronitrile,butanenitrile, 4-chloro,butyronitrile, 4-chloro,gamma-chlorobutyronitrile,1-chloro-3-cyanopropane,4-chloro-butyronitrile,.gamma.-chlorobutyronitrile,4chlorobutyronitrile,4-chlorobutyroonitrile,4-chloro-butanenitrile PubChem CID: 12336 IUPAC Name: 4-chlorobutanenitrile SMILES: ClCCCC#N

PubChem CID 12336
CAS 628-20-6
Molecular Weight (g/mol) 103.55
MDL Number MFCD00001972
SMILES ClCCCC#N
Synonym 4-chlorobutyronitrile,butanenitrile, 4-chloro,butyronitrile, 4-chloro,gamma-chlorobutyronitrile,1-chloro-3-cyanopropane,4-chloro-butyronitrile,.gamma.-chlorobutyronitrile,4chlorobutyronitrile,4-chlorobutyroonitrile,4-chloro-butanenitrile
IUPAC Name 4-chlorobutanenitrile
InChI Key ZFCFBWSVQWGOJJ-UHFFFAOYSA-N
Molecular Formula C4H6ClN
9

2-Chloroethylamine hydrochloride, 98+%

CAS: 870-24-6 Molecular Formula: C2H7Cl2N Molecular Weight (g/mol): 115.99 MDL Number: MFCD00012887,MFCD00137399 InChI Key: ONRREFWJTRBDRA-UHFFFAOYSA-N Synonym: 2-chloroethylamine hydrochloride,2-chloroethanamine hydrochloride,1-amino-2-chloroethane hydrochloride,ethanamine, 2-chloro-, hydrochloride,2-aminoethyl chloride hydrochloride,ethanamine, 2-chloro-, hydrochloride 1:1,2-chloroethan-1-amine hydrochloride,chlorethamine hydrochloride,2-chloro-ethylamine hydrochloride,chlorethamine hcl PubChem CID: 9793737 IUPAC Name: 2-chloroethanamine;hydrochloride SMILES: [Cl-].[NH3+]CCCl

PubChem CID 9793737
CAS 870-24-6
Molecular Weight (g/mol) 115.99
MDL Number MFCD00012887,MFCD00137399
SMILES [Cl-].[NH3+]CCCl
Synonym 2-chloroethylamine hydrochloride,2-chloroethanamine hydrochloride,1-amino-2-chloroethane hydrochloride,ethanamine, 2-chloro-, hydrochloride,2-aminoethyl chloride hydrochloride,ethanamine, 2-chloro-, hydrochloride 1:1,2-chloroethan-1-amine hydrochloride,chlorethamine hydrochloride,2-chloro-ethylamine hydrochloride,chlorethamine hcl
IUPAC Name 2-chloroethanamine;hydrochloride
InChI Key ONRREFWJTRBDRA-UHFFFAOYSA-N
Molecular Formula C2H7Cl2N
10

Benzyl 2,2,2-trichloroacetimidate, 98%

CAS: 81927-55-1 Molecular Formula: C9H8Cl3NO Molecular Weight (g/mol): 252.52 MDL Number: MFCD00000805 InChI Key: HUZCTWYDQIQZPM-UHFFFAOYSA-N PubChem CID: 144968 IUPAC Name: benzyl 2,2,2-trichloroethanimidate SMILES: ClC(Cl)(Cl)C(=N)OCC1=CC=CC=C1

PubChem CID 144968
CAS 81927-55-1
Molecular Weight (g/mol) 252.52
MDL Number MFCD00000805
SMILES ClC(Cl)(Cl)C(=N)OCC1=CC=CC=C1
IUPAC Name benzyl 2,2,2-trichloroethanimidate
InChI Key HUZCTWYDQIQZPM-UHFFFAOYSA-N
Molecular Formula C9H8Cl3NO
11

Isobutyl chloroformate, 98%, AcroSeal™

CAS: 543-27-1 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.58 MDL Number: MFCD00000642 InChI Key: YOETUEMZNOLGDB-UHFFFAOYSA-N Synonym: isobutyl chloroformate,2-methylpropyl chloroformate,chloroformic acid isobutyl ester,isobutyl chlorocarbonate,carbonochloridic acid, 2-methylpropyl ester,isobutylchloroformate,i-butyl chloroformate,chlorocarbonic acid isobutyl ester,isobutyl carbonochloridate,unii-6s785tc0ob PubChem CID: 62365 IUPAC Name: 2-methylpropyl carbonochloridate SMILES: CC(C)COC(=O)Cl

PubChem CID 62365
CAS 543-27-1
Molecular Weight (g/mol) 136.58
MDL Number MFCD00000642
SMILES CC(C)COC(=O)Cl
Synonym isobutyl chloroformate,2-methylpropyl chloroformate,chloroformic acid isobutyl ester,isobutyl chlorocarbonate,carbonochloridic acid, 2-methylpropyl ester,isobutylchloroformate,i-butyl chloroformate,chlorocarbonic acid isobutyl ester,isobutyl carbonochloridate,unii-6s785tc0ob
IUPAC Name 2-methylpropyl carbonochloridate
InChI Key YOETUEMZNOLGDB-UHFFFAOYSA-N
Molecular Formula C5H9ClO2
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-Chloro-2-pentanone, 94%

CAS: 5891-21-4 Molecular Formula: C5H9ClO Molecular Weight (g/mol): 120.576 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) 120.576
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
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

1-Chlorohexadecane, 97%

CAS: 4860-03-1 MDL Number: MFCD00000959

CAS 4860-03-1
MDL Number MFCD00000959