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Home > Nitro Compounds > 87740-03-2
87740-03-2 | 1,1'-Biphenyl, 3-[(3-nitrophenyl)methoxy]-
CAS No: 87740-03-2 Catalog No: AG004LNR MDL No:
Product Description
Catalog Number:
AG004LNR
Chemical Name:
1,1'-Biphenyl, 3-[(3-nitrophenyl)methoxy]-
CAS Number:
87740-03-2
Molecular Formula:
C19H15NO3
Molecular Weight:
305.3273
IUPAC Name:
1-nitro-3-[(3-phenylphenoxy)methyl]benzene
InChI:
InChI=1S/C19H15NO3/c21-20(22)18-10-4-6-15(12-18)14-23-19-11-5-9-17(13-19)16-7-2-1-3-8-16/h1-13H,14H2
InChI Key:
QAEDPWDWBWBAQA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)COc1cccc(c1)c1ccccc1
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.105g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.333g/mol
Monoisotopic Mass:
305.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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