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Home > Nitro Compounds > 1699-54-3
1699-54-3 | 3,4-Dibenzyloxy-trans-β-nitrostyrene
CAS No: 1699-54-3 Catalog No: AG003IFL MDL No:
Product Description
Catalog Number:
AG003IFL
Chemical Name:
3,4-Dibenzyloxy-trans-β-nitrostyrene
CAS Number:
1699-54-3
IUPAC Name:
4-[(E)-2-nitroethenyl]-1,2-bis(phenylmethoxy)benzene
InChI:
InChI=1S/C22H19NO4/c24-23(25)14-13-18-11-12-21(26-16-19-7-3-1-4-8-19)22(15-18)27-17-20-9-5-2-6-10-20/h1-15H,16-17H2/b14-13+
InChI Key:
CHTJRVASYXOBSO-BUHFOSPRSA-N
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
361.131g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.397g/mol
Monoisotopic Mass:
361.131g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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