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2037-31-2,MFCD00004839
Catalog No.:AA003J92
2037-31-2 | 3-Chlorothiophenol
Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
>97.0%(GC)
1 week  
$46.00   $32.00
- +
25g
>97.0%(GC)
1 week  
$112.00   $78.00
- +
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Technical Information
Catalog Number:
AA003J92
Chemical Name:
3-Chlorothiophenol
CAS Number:
2037-31-2
Molecular Formula:
C6H5ClS
Molecular Weight:
144.6219
MDL Number:
MFCD00004839
IUPAC Name:
3-chlorobenzenethiol
InChI:
InChI=1S/C6H5ClS/c7-5-2-1-3-6(8)4-5/h1-4,8H
InChI Key:
CQJDYPZUDYXHLM-UHFFFAOYSA-N
SMILES:
Sc1cccc(c1)Cl
EC Number:
218-010-0
NSC Number:
32020
Properties
Computed Properties
 
Complexity:
74.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.98g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
144.616g/mol
Monoisotopic Mass:
143.98g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

Synonyms
 
3-Chlorothiophenol 
3-CHLOROBENZENETHIOL 
3-Chloromercaptobenzene 
m-chlorophenyl mercaptan 
MFCD00004839 
CQJDYPZUDYXHLM-UHFFFAOYSA-N 
NSC32020 
3-chloro-thiophenol 
EINECS 218-010-0 
3-chloro-benzenethio 
NSC 32020 
PubChem6785 
2037-31-2 
ACMC-1CQWE 
3-Chlorothiophenol, 97% 
AC1L27KT 
AC1Q7G9H 
3-Chlorobenzenethiol, 97% 
SCHEMBL48358 
KSC204E7J 
CHEMBL332620 
Jsp004165 
DTXSID7062116 
m-Chlorothiophenol 
Benzenethiol, m-chloro- (8CI) 
CTK1A4274 
KS-00000ZOP 
ZINC152948 
ACT03002 
ANW-24052 
NSC-32020 
AKOS006223919 
NE10360 
PS-5376 
Benzenethiol, 3-chloro- 
RP20968 
TRA0063909 
VZ26687 
AN-50303 
BR-48008 
L518 
SC-46622 
TL806314 
DB-045187 
TC-112797 
3-chlorobenzene-1-thiol 
FT-0615458 
EN300-64688 
J-512349 
C6H5ClS 
C6-H5-Cl-S 
4,5-Difluoro-2-nitrobenzoic acid 
CID16257 
3-Chlorothiophenol, 97% - 25G 25g 
C1582 
m-Chlorobenzenethiol 
Benzenethiol, m-chloro- 
3-Chloro thiophenol 
3-Chloro-benzenethiol 
Literature
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