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141357-93-9 | Benzenemethanamine, N,N-dimethyl-3-(phenylthio)-
CAS No: 141357-93-9 Catalog No: AG001GAQ MDL No:
Product Description
Catalog Number:
AG001GAQ
Chemical Name:
Benzenemethanamine, N,N-dimethyl-3-(phenylthio)-
CAS Number:
141357-93-9
Molecular Formula:
C15H17NS
Molecular Weight:
243.3672
IUPAC Name:
N,N-dimethyl-1-(3-phenylsulfanylphenyl)methanamine
InChI:
InChI=1S/C15H17NS/c1-16(2)12-13-7-6-10-15(11-13)17-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3
InChI Key:
FGXDDHRSIBTVDV-UHFFFAOYSA-N
SMILES:
CN(Cc1cccc(c1)Sc1ccccc1)C
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.108g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.368g/mol
Monoisotopic Mass:
243.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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