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125775-57-7 | Benzenamine, N,N-diphenyl-4-(2H-tetrazol-5-yl)-
CAS No: 125775-57-7 Catalog No: AG000OPW MDL No:
Product Description
Catalog Number:
AG000OPW
Chemical Name:
Benzenamine, N,N-diphenyl-4-(2H-tetrazol-5-yl)-
CAS Number:
125775-57-7
Molecular Formula:
C19H15N5
Molecular Weight:
313.3559
IUPAC Name:
N,N-diphenyl-4-(2H-tetrazol-5-yl)aniline
InChI:
InChI=1S/C19H15N5/c1-3-7-16(8-4-1)24(17-9-5-2-6-10-17)18-13-11-15(12-14-18)19-20-22-23-21-19/h1-14H,(H,20,21,22,23)
InChI Key:
RSUKTFJQJKAZSH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N(c1ccccc1)c1ccc(cc1)c1n[nH]nn1
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.133g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
313.364g/mol
Monoisotopic Mass:
313.133g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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