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Organochlorides

Organic compounds that contain one or more chlorine atoms.
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Keyword Search:
1 – 15 of 72 results
1

Tetrachloroethylene, MilliporeSigma™

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
2

Chlorendic Acid 98.0+%, TCI America™

CAS: 115-28-6 Molecular Formula: C9H4Cl6O4 Molecular Weight (g/mol): 388.827 MDL Number: MFCD00167589 InChI Key: DJKGDNKYTKCJKD-UHFFFAOYSA-N Synonym: Het Acid, 1,4,5,6,7,7-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic Acid, Hexachloro-endo-methylenetetrahydrophthalic Acid PubChem CID: 8266 ChEBI: CHEBI:76603 IUPAC Name: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid SMILES: C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O

PubChem CID 8266
CAS 115-28-6
Molecular Weight (g/mol) 388.827
ChEBI CHEBI:76603
MDL Number MFCD00167589
SMILES C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O
Synonym Het Acid, 1,4,5,6,7,7-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic Acid, Hexachloro-endo-methylenetetrahydrophthalic Acid
IUPAC Name 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid
InChI Key DJKGDNKYTKCJKD-UHFFFAOYSA-N
Molecular Formula C9H4Cl6O4
3

3-Chloropropionic Acid 98.0+%, TCI America™

CAS: 107-94-8 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.52 MDL Number: MFCD00002764 InChI Key: QEYMMOKECZBKAC-UHFFFAOYSA-N Synonym: 3-chloropropionic acid,propanoic acid, 3-chloro,propionic acid, 3-chloro,beta-chloropropionic acid,3-chloropropanic acid,beta-monochloropropionic acid,unii-r5j180fn9z,3-chloro-propionic acid,.beta.-chloropropionic acid,.beta.-monochloropropionic acid PubChem CID: 7899 IUPAC Name: 3-chloropropanoic acid SMILES: OC(=O)CCCl

PubChem CID 7899
CAS 107-94-8
Molecular Weight (g/mol) 108.52
MDL Number MFCD00002764
SMILES OC(=O)CCCl
Synonym 3-chloropropionic acid,propanoic acid, 3-chloro,propionic acid, 3-chloro,beta-chloropropionic acid,3-chloropropanic acid,beta-monochloropropionic acid,unii-r5j180fn9z,3-chloro-propionic acid,.beta.-chloropropionic acid,.beta.-monochloropropionic acid
IUPAC Name 3-chloropropanoic acid
InChI Key QEYMMOKECZBKAC-UHFFFAOYSA-N
Molecular Formula C3H5ClO2
4

3-Chloropivalic Acid 98.0+%, TCI America™

CAS: 13511-38-1 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.58 MDL Number: MFCD00004195 InChI Key: YBJGQSNSAWZZHL-UHFFFAOYSA-N Synonym: 3-Chloro-2,2-dimethylpropionic Acid PubChem CID: 83542 IUPAC Name: 3-chloro-2,2-dimethylpropanoic acid SMILES: CC(C)(CCl)C(O)=O

PubChem CID 83542
CAS 13511-38-1
Molecular Weight (g/mol) 136.58
MDL Number MFCD00004195
SMILES CC(C)(CCl)C(O)=O
Synonym 3-Chloro-2,2-dimethylpropionic Acid
IUPAC Name 3-chloro-2,2-dimethylpropanoic acid
InChI Key YBJGQSNSAWZZHL-UHFFFAOYSA-N
Molecular Formula C5H9ClO2
5

1-Chlorobutane, MilliporeSigma™

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
6

1,1,2,2-Tetrachloroethane, MilliporeSigma™

CAS: 79-34-5 Molecular Formula: C2H2Cl4 Molecular Weight (g/mol): 167.838 InChI Key: QPFMBZIOSGYJDE-UHFFFAOYSA-N Synonym: s-tetrachloroethane,acetylene tetrachloride,ethane, 1,1,2,2-tetrachloro,bonoform,cellon,tetrachlorethane,sym-tetrachloroethane,westron,1,1,2,2-tetrachlorethane,1,1,2,2-tetrachloraethan PubChem CID: 6591 ChEBI: CHEBI:36026 IUPAC Name: 1,1,2,2-tetrachloroethane SMILES: C(C(Cl)Cl)(Cl)Cl

PubChem CID 6591
CAS 79-34-5
Molecular Weight (g/mol) 167.838
ChEBI CHEBI:36026
SMILES C(C(Cl)Cl)(Cl)Cl
Synonym s-tetrachloroethane,acetylene tetrachloride,ethane, 1,1,2,2-tetrachloro,bonoform,cellon,tetrachlorethane,sym-tetrachloroethane,westron,1,1,2,2-tetrachlorethane,1,1,2,2-tetrachloraethan
IUPAC Name 1,1,2,2-tetrachloroethane
InChI Key QPFMBZIOSGYJDE-UHFFFAOYSA-N
Molecular Formula C2H2Cl4
7

Dodecyl Chloroformate 90.0+%, TCI America™

CAS: 24460-74-0 Molecular Formula: C13H25ClO2 Molecular Weight (g/mol): 248.791 InChI Key: AFPOMDNRTZLRMD-UHFFFAOYSA-N Synonym: Chloroformic Acid Dodecyl Ester, Chloroformic Acid Lauryl Ester, Lauryl Chloroformate PubChem CID: 90513 IUPAC Name: dodecyl carbonochloridate SMILES: CCCCCCCCCCCCOC(=O)Cl

PubChem CID 90513
CAS 24460-74-0
Molecular Weight (g/mol) 248.791
SMILES CCCCCCCCCCCCOC(=O)Cl
Synonym Chloroformic Acid Dodecyl Ester, Chloroformic Acid Lauryl Ester, Lauryl Chloroformate
IUPAC Name dodecyl carbonochloridate
InChI Key AFPOMDNRTZLRMD-UHFFFAOYSA-N
Molecular Formula C13H25ClO2
8

2-Chloroethyl Chloroformate 98.0+%, TCI America™

CAS: 627-11-2 Molecular Formula: C3H4Cl2O2 Molecular Weight (g/mol): 142.96 MDL Number: MFCD00000646 InChI Key: SVDDJQGVOFZBNX-UHFFFAOYSA-N Synonym: 2-chloroethyl chloroformate,chloroethyl chloroformate,carbonochloridic acid, 2-chloroethyl ester,chloroformic acid 2-chloroethyl ester,formic acid, chloro-, 2-chloroethyl ester,chloroethylchloroformate,2-chloroethylchloroformate,unii-4d32h07z9i,beta-chloroethyl chlorocarbonate,chloroformic acid, beta-chloroethyl ester PubChem CID: 12305 IUPAC Name: 2-chloroethyl carbonochloridate SMILES: ClCCOC(Cl)=O

PubChem CID 12305
CAS 627-11-2
Molecular Weight (g/mol) 142.96
MDL Number MFCD00000646
SMILES ClCCOC(Cl)=O
Synonym 2-chloroethyl chloroformate,chloroethyl chloroformate,carbonochloridic acid, 2-chloroethyl ester,chloroformic acid 2-chloroethyl ester,formic acid, chloro-, 2-chloroethyl ester,chloroethylchloroformate,2-chloroethylchloroformate,unii-4d32h07z9i,beta-chloroethyl chlorocarbonate,chloroformic acid, beta-chloroethyl ester
IUPAC Name 2-chloroethyl carbonochloridate
InChI Key SVDDJQGVOFZBNX-UHFFFAOYSA-N
Molecular Formula C3H4Cl2O2
9

Ethyl 4-Chlorobutyrate 98.0+%, TCI America™

CAS: 3153-36-4 Molecular Formula: C6H11ClO2 Molecular Weight (g/mol): 150.602 MDL Number: MFCD00001004 InChI Key: OPXNFHAILOHHFO-UHFFFAOYSA-N Synonym: ethyl 4-chlorobutyrate,butanoic acid, 4-chloro-, ethyl ester,ethyl gamma-chlorobutyrate,ethyl-4-chlorobutyrate,4-chloro-butyric acid ethyl ester,butyric acid, 4-chloro-, ethyl ester,ethyl .gamma.-chlorobutyrate,4-chlorobutyric acid ethyl ester,ethyl 4chlorobutyrate,acmc-1cqjw PubChem CID: 18474 IUPAC Name: ethyl 4-chlorobutanoate SMILES: CCOC(=O)CCCCl

PubChem CID 18474
CAS 3153-36-4
Molecular Weight (g/mol) 150.602
MDL Number MFCD00001004
SMILES CCOC(=O)CCCCl
Synonym ethyl 4-chlorobutyrate,butanoic acid, 4-chloro-, ethyl ester,ethyl gamma-chlorobutyrate,ethyl-4-chlorobutyrate,4-chloro-butyric acid ethyl ester,butyric acid, 4-chloro-, ethyl ester,ethyl .gamma.-chlorobutyrate,4-chlorobutyric acid ethyl ester,ethyl 4chlorobutyrate,acmc-1cqjw
IUPAC Name ethyl 4-chlorobutanoate
InChI Key OPXNFHAILOHHFO-UHFFFAOYSA-N
Molecular Formula C6H11ClO2
10

3-Chloropropyl Chloroformate 95.0+%, TCI America™

CAS: 628-11-5 Molecular Formula: C4H6Cl2O2 Molecular Weight (g/mol): 156.99 InChI Key: MTXMEFUEBCFWCY-UHFFFAOYSA-N Synonym: Chloroformic Acid 3-Chloropropyl Ester PubChem CID: 69399 IUPAC Name: 3-chloropropyl carbonochloridate SMILES: C(COC(=O)Cl)CCl

PubChem CID 69399
CAS 628-11-5
Molecular Weight (g/mol) 156.99
SMILES C(COC(=O)Cl)CCl
Synonym Chloroformic Acid 3-Chloropropyl Ester
IUPAC Name 3-chloropropyl carbonochloridate
InChI Key MTXMEFUEBCFWCY-UHFFFAOYSA-N
Molecular Formula C4H6Cl2O2
11

Decyl Chloroformate 95.0+%, TCI America™

CAS: 55488-51-2 Molecular Formula: C11H21ClO2 Molecular Weight (g/mol): 220.737 MDL Number: MFCD00126853 InChI Key: AZZCHVHSWUYCQA-UHFFFAOYSA-N Synonym: Chloroformic Acid Decyl Ester PubChem CID: 108727 IUPAC Name: decyl carbonochloridate SMILES: CCCCCCCCCCOC(=O)Cl

PubChem CID 108727
CAS 55488-51-2
Molecular Weight (g/mol) 220.737
MDL Number MFCD00126853
SMILES CCCCCCCCCCOC(=O)Cl
Synonym Chloroformic Acid Decyl Ester
IUPAC Name decyl carbonochloridate
InChI Key AZZCHVHSWUYCQA-UHFFFAOYSA-N
Molecular Formula C11H21ClO2
12

Nonyl Chloroformate 95.0+%, TCI America™

CAS: 57045-82-6 Molecular Formula: C10H19ClO2 Molecular Weight (g/mol): 206.71 MDL Number: MFCD00059485 InChI Key: VKOFPDUSOTWTPX-UHFFFAOYSA-N Synonym: Chloroformic Acid Nonyl Ester PubChem CID: 544663 IUPAC Name: nonyl carbonochloridate SMILES: CCCCCCCCCOC(=O)Cl

PubChem CID 544663
CAS 57045-82-6
Molecular Weight (g/mol) 206.71
MDL Number MFCD00059485
SMILES CCCCCCCCCOC(=O)Cl
Synonym Chloroformic Acid Nonyl Ester
IUPAC Name nonyl carbonochloridate
InChI Key VKOFPDUSOTWTPX-UHFFFAOYSA-N
Molecular Formula C10H19ClO2
13

Heptyl Chloroformate 98.0+%, TCI America™

CAS: 33758-34-8 Molecular Formula: C8H15ClO2 Molecular Weight (g/mol): 178.656 MDL Number: MFCD00059484 InChI Key: SATRZZYUXUGZIE-UHFFFAOYSA-N Synonym: Chloroformic Acid Heptyl Ester PubChem CID: 118547 IUPAC Name: heptyl carbonochloridate SMILES: CCCCCCCOC(=O)Cl

PubChem CID 118547
CAS 33758-34-8
Molecular Weight (g/mol) 178.656
MDL Number MFCD00059484
SMILES CCCCCCCOC(=O)Cl
Synonym Chloroformic Acid Heptyl Ester
IUPAC Name heptyl carbonochloridate
InChI Key SATRZZYUXUGZIE-UHFFFAOYSA-N
Molecular Formula C8H15ClO2
14

Chloromethyl Butyrate 98.0+%, TCI America™

CAS: 33657-49-7 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.575 MDL Number: MFCD00216961 InChI Key: BDPZFQLKFUONAG-UHFFFAOYSA-N Synonym: chloromethyl butyrate,chloromethylbutyrate,butyric acid chloromethyl ester,butanoic acid, chloromethyl ester,chloromethyl n-butanoate,butyryloxymethyl chloride,acmc-1agry,ksc492g7j,butanoic acid,chloromethyl ester,n-butanoic acid chloromethyl ester PubChem CID: 2725008 IUPAC Name: chloromethyl butanoate SMILES: CCCC(=O)OCCl

PubChem CID 2725008
CAS 33657-49-7
Molecular Weight (g/mol) 136.575
MDL Number MFCD00216961
SMILES CCCC(=O)OCCl
Synonym chloromethyl butyrate,chloromethylbutyrate,butyric acid chloromethyl ester,butanoic acid, chloromethyl ester,chloromethyl n-butanoate,butyryloxymethyl chloride,acmc-1agry,ksc492g7j,butanoic acid,chloromethyl ester,n-butanoic acid chloromethyl ester
IUPAC Name chloromethyl butanoate
InChI Key BDPZFQLKFUONAG-UHFFFAOYSA-N
Molecular Formula C5H9ClO2
15

Hexyl Chloroformate 98.0+%, TCI America™

CAS: 6092-54-2 Molecular Formula: C7H13ClO2 Molecular Weight (g/mol): 164.63 MDL Number: MFCD00000651 InChI Key: KIWBRXCOTCXSSZ-UHFFFAOYSA-N Synonym: hexyl chloroformate,carbonochloridic acid, hexyl ester,n-hexyl chloroformate,chloroformic acid n-hexyl ester,hexyl chlorocarbonate,unii-mu6004c2z3,chloro hexyloxy methanone,chloroformic acid hexyl ester,hexylchloroformate,hexyl=chloroformate PubChem CID: 22466 IUPAC Name: hexyl carbonochloridate SMILES: CCCCCCOC(Cl)=O

PubChem CID 22466
CAS 6092-54-2
Molecular Weight (g/mol) 164.63
MDL Number MFCD00000651
SMILES CCCCCCOC(Cl)=O
Synonym hexyl chloroformate,carbonochloridic acid, hexyl ester,n-hexyl chloroformate,chloroformic acid n-hexyl ester,hexyl chlorocarbonate,unii-mu6004c2z3,chloro hexyloxy methanone,chloroformic acid hexyl ester,hexylchloroformate,hexyl=chloroformate
IUPAC Name hexyl carbonochloridate
InChI Key KIWBRXCOTCXSSZ-UHFFFAOYSA-N
Molecular Formula C7H13ClO2