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134811-95-3 | 3-(4-phenyl-1,3-thiazol-2-yl)aniline
CAS No: 134811-95-3 Catalog No: AG01DHQH MDL No:MFCD01936139
Product Description
Catalog Number:
AG01DHQH
Chemical Name:
3-(4-phenyl-1,3-thiazol-2-yl)aniline
CAS Number:
134811-95-3
Molecular Formula:
C15H12N2S
Molecular Weight:
252.3342
MDL Number:
MFCD01936139
IUPAC Name:
3-(4-phenyl-1,3-thiazol-2-yl)aniline
InChI:
InChI=1S/C15H12N2S/c16-13-8-4-7-12(9-13)15-17-14(10-18-15)11-5-2-1-3-6-11/h1-10H,16H2
InChI Key:
PPBSCESYWWRRAX-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)c1scc(n1)c1ccccc1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.072g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.335g/mol
Monoisotopic Mass:
252.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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