Home Halogens Benzenamine, 3-chloro-2-[(1-methylethyl)thio]-

Benzenamine, 3-chloro-2-[(1-methylethyl)thio]-

CAS No.:
179104-32-6
Catalog Number:
AG0026SV
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
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Product Description
Catalog Number:
AG0026SV
Chemical Name:
Benzenamine, 3-chloro-2-[(1-methylethyl)thio]-
CAS Number:
179104-32-6
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
MDL Number:
MFCD00831111
IUPAC Name:
3-chloro-2-propan-2-ylsulfanylaniline
InChI:
InChI=1S/C9H12ClNS/c1-6(2)12-9-7(10)4-3-5-8(9)11/h3-6H,11H2,1-2H3
InChI Key:
HJYRCWDQTVQNJV-UHFFFAOYSA-N
SMILES:
CC(Sc1c(N)cccc1Cl)C
EC Number:
421-700-6
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