Home Other Building Blocks {4-[(trifluoromethyl)sulfanyl]phenyl}methanamine hydrochloride

{4-[(trifluoromethyl)sulfanyl]phenyl}methanamine hydrochloride

CAS No.:
127842-66-4
Catalog Number:
AG01B6YM
Molecular Formula:
C8H9ClF3NS
Molecular Weight:
243.6770
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Product Description
Catalog Number:
AG01B6YM
Chemical Name:
{4-[(trifluoromethyl)sulfanyl]phenyl}methanamine hydrochloride
CAS Number:
127842-66-4
Molecular Formula:
C8H9ClF3NS
Molecular Weight:
243.6770
MDL Number:
MFCD30342983
IUPAC Name:
[4-(trifluoromethylsulfanyl)phenyl]methanamine;hydrochloride
InChI:
InChI=1S/C8H8F3NS.ClH/c9-8(10,11)13-7-3-1-6(5-12)2-4-7;/h1-4H,5,12H2;1H
InChI Key:
HSSWIGTXFACQPN-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)SC(F)(F)F.Cl
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.01g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.672g/mol
Monoisotopic Mass:
243.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties