Home Halogens 2-(3-chlorophenyl)-2-(methylsulfanyl)ethan-1-amine

2-(3-chlorophenyl)-2-(methylsulfanyl)ethan-1-amine

CAS No.:
1248601-56-0
Catalog Number:
AG01AHAU
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
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Product Description
Catalog Number:
AG01AHAU
Chemical Name:
2-(3-chlorophenyl)-2-(methylsulfanyl)ethan-1-amine
CAS Number:
1248601-56-0
Molecular Formula:
C9H12ClNS
Molecular Weight:
201.7163
MDL Number:
MFCD16062547
IUPAC Name:
2-(3-chlorophenyl)-2-methylsulfanylethanamine
InChI:
InChI=1S/C9H12ClNS/c1-12-9(6-11)7-3-2-4-8(10)5-7/h2-5,9H,6,11H2,1H3
InChI Key:
WFKVGLKWRNPJIE-UHFFFAOYSA-N
SMILES:
CSC(c1cccc(c1)Cl)CN
Properties
Complexity:
132  
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:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties