Home Halogens 3-chloro-4-[(4-methoxyphenyl)sulfanyl]aniline

3-chloro-4-[(4-methoxyphenyl)sulfanyl]aniline

CAS No.:
23724-54-1
Catalog Number:
AG019XZE
Molecular Formula:
C13H12ClNOS
Molecular Weight:
265.7585
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Product Description
Catalog Number:
AG019XZE
Chemical Name:
3-chloro-4-[(4-methoxyphenyl)sulfanyl]aniline
CAS Number:
23724-54-1
Molecular Formula:
C13H12ClNOS
Molecular Weight:
265.7585
MDL Number:
MFCD11132355
IUPAC Name:
3-chloro-4-(4-methoxyphenyl)sulfanylaniline
InChI:
InChI=1S/C13H12ClNOS/c1-16-10-3-5-11(6-4-10)17-13-7-2-9(15)8-12(13)14/h2-8H,15H2,1H3
InChI Key:
CZKIDNZYRALHKV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Sc1ccc(cc1Cl)N
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.033g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
265.755g/mol
Monoisotopic Mass:
265.033g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties