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

{4-[(4-fluorophenyl)sulfanyl]phenyl}methanamine

CAS No.:
1156220-21-1
Catalog Number:
AG01A4G3
Molecular Formula:
C13H12FNS
Molecular Weight:
233.3045
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Product Description
Catalog Number:
AG01A4G3
Chemical Name:
{4-[(4-fluorophenyl)sulfanyl]phenyl}methanamine
CAS Number:
1156220-21-1
Molecular Formula:
C13H12FNS
Molecular Weight:
233.3045
MDL Number:
MFCD12191936
IUPAC Name:
[4-(4-fluorophenyl)sulfanylphenyl]methanamine
InChI:
InChI=1S/C13H12FNS/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12/h1-8H,9,15H2
InChI Key:
KJTXHQSTASGELX-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)Sc1ccc(cc1)F
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.067g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.304g/mol
Monoisotopic Mass:
233.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties