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16240-68-9 | Carbonic dihydrazide, bis(diphenylmethylene)- (9CI)
CAS No: 16240-68-9 Catalog No: AG001T2K MDL No:
Product Description
Catalog Number:
AG001T2K
Chemical Name:
Carbonic dihydrazide, bis(diphenylmethylene)- (9CI)
CAS Number:
16240-68-9
Molecular Formula:
C27H22N4O
Molecular Weight:
418.4898
IUPAC Name:
1,3-bis(benzhydrylideneamino)urea
InChI:
InChI=1S/C27H22N4O/c32-27(30-28-25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)31-29-26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H,(H2,30,31,32)
InChI Key:
HEIXFRUNTYCUTF-UHFFFAOYSA-N
SMILES:
O=C(NN=C(c1ccccc1)c1ccccc1)NN=C(c1ccccc1)c1ccccc1
Properties
Complexity:
540
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.179g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
418.5g/mol
Monoisotopic Mass:
418.179g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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