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Home > Nitro Compounds > 893743-31-2
893743-31-2 | [1,1'-Biphenyl]-3-methanol,3'-nitro-
CAS No: 893743-31-2 Catalog No: AG003WGB MDL No:
Product Description
Catalog Number:
AG003WGB
Chemical Name:
[1,1'-Biphenyl]-3-methanol,3'-nitro-
CAS Number:
893743-31-2
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
IUPAC Name:
[3-(3-nitrophenyl)phenyl]methanol
InChI:
InChI=1S/C13H11NO3/c15-9-10-3-1-4-11(7-10)12-5-2-6-13(8-12)14(16)17/h1-8,15H,9H2
InChI Key:
WLNYHFRSZASVKC-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.235g/mol
Monoisotopic Mass:
229.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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