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850375-02-9 | 5-Thiazolemethanamine,N,4-dimethyl-2-phenyl-
CAS No: 850375-02-9 Catalog No: AG004SVD MDL No:MFCD07368511
Product Description
Catalog Number:
AG004SVD
Chemical Name:
5-Thiazolemethanamine,N,4-dimethyl-2-phenyl-
CAS Number:
850375-02-9
Molecular Formula:
C12H14N2S
Molecular Weight:
218.3180
MDL Number:
MFCD07368511
IUPAC Name:
N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine
InChI:
InChI=1S/C12H14N2S/c1-9-11(8-13-2)15-12(14-9)10-6-4-3-5-7-10/h3-7,13H,8H2,1-2H3
InChI Key:
GFAGRBRYZWAUSV-UHFFFAOYSA-N
SMILES:
CNCc1sc(nc1C)c1ccccc1
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.088g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.318g/mol
Monoisotopic Mass:
218.088g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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