Home Amines 1004-00-8
1004-00-8,MFCD00792528
Catalog No.:AA0001TP
1004-00-8 | 2-Amino-4-chlorothiophenol
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$14.00   $10.00
- +
5g
95%
in stock  
$26.00   $18.00
- +
25g
95%
in stock  
$71.00   $50.00
- +
100g
95%
in stock  
$236.00   $165.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0001TP
Chemical Name:
2-Amino-4-chlorothiophenol
CAS Number:
1004-00-8
Molecular Formula:
C6H6ClNS
Molecular Weight:
159.6365
MDL Number:
MFCD00792528
IUPAC Name:
2-amino-4-chlorobenzenethiol
InChI:
InChI=1S/C6H6ClNS/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
InChI Key:
NGIRMPARLVGMPX-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)N)S
Properties
Computed Properties
 
Complexity:
99.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.991g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
159.631g/mol
Monoisotopic Mass:
158.991g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
2-amino-4-chlorobenzenethiol 
2-Amino-4-chlorobenzenethiol 
NSC6957 
2-Amino-4-chloro thiophenol 
2-Amino-4-chlorothiophenol, 96% 
5-Chloro-2-mercaptoaniline hydrochloride 
Benzenethiol, 2-amino-4-chloro-, hydrochloride 
PubChem5427 
AC1L1YMC 
2-ao-4-Chloro thiophenol 
ACMC-1C9E5 
4-Chloro-2-aminobenzenethiol 
1004-00-8 
5-Chloro-2-mercaptoaniline- 
KSC491G9B 
SCHEMBL485284 
Jsp000110 
Aniline, 5-chloro-2-mercapto- 
Benzenethiol,2-amino-4-chloro- 
CTK3J1390 
2-Amino-4-chlorophenyl mercaptan 
DTXSID00143244 
2-azanyl-4-chloranyl-benzenethiol 
2-Amino-4-chlorothiophenol 
NGIRMPARLVGMPX-UHFFFAOYSA-N 
ZINC404031 
AC1Q5198 
KS-000016ML 
STR07514 
2-Amino-4-chlorophenyl hydrosulfide 
2-Amino-4-chlorobenzenethiol, 96% 
ANW-14274 
BBL100251 
SBB066509 
2-amino-4-chlorobenzene-1-thiol 
STL553820 
AKOS000298976 
MCULE-2557906969 
NE62281 
PS-3202 
RP22311 
TRA0039335 
VZ23619 
AC-11158 
AN-48259 
Benzenethiol, 2-amino-4-chloro- 
S987 
SC-00031 
AB0018879 
DB-005932 
RT-001938 
TL8006729 
FT-0601195 
ST50824758 
EN300-21735 
A800195 
2-amino-4-chloro-benzenethiol 
I09-0817 
J-507853 
F8889-1244 
Z431531594 
C6H6ClNS 
C6-H6-Cl-N-S 
CID12000 
A1625 
2-Amino-4-chloro thiophenol, 97% - 25G 25g 
ANILINE, 5-CHLORO-2-MERCAPTO-, HYDROCHLORIDE 
4-Chloro-2-aminothiophenol 
615-48-5 
5-Chloro-2-mercaptoaniline 
MFCD00792528 
Literature

Title: 5-Chloro-4'-ethyl-3H-spiro-[1,3-benzo-thia-zole-2,1'-cyclo-hexa-ne].

Journal: Acta crystallographica. Section E, Structure reports online 20120501

Title: 4'-tert-Butyl-5-chloro-3H-spiro-[1,3-benzothia-zole-2,1'-cyclo-hexa-ne].

Journal: Acta crystallographica. Section E, Structure reports online 20120501

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