Home Halogens 5-chloro-2-(propan-2-ylsulfanyl)aniline

5-chloro-2-(propan-2-ylsulfanyl)aniline

CAS No.:
1019455-04-9
Catalog Number:
AG01AAXA
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
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Product Description
Catalog Number:
AG01AAXA
Chemical Name:
5-chloro-2-(propan-2-ylsulfanyl)aniline
CAS Number:
1019455-04-9
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
MDL Number:
MFCD11128893
IUPAC Name:
5-chloro-2-propan-2-ylsulfanylaniline
InChI:
InChI=1S/C9H12ClNS/c1-6(2)12-9-4-3-7(10)5-8(9)11/h3-6H,11H2,1-2H3
InChI Key:
NOUBLSSWMKCEQK-UHFFFAOYSA-N
SMILES:
CC(Sc1ccc(cc1N)Cl)C
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.712g/mol
Monoisotopic Mass:
201.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties