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Home > Nitro Compounds > 3916-44-7
3916-44-7 | 4'-Nitro-[1,1'-biphenyl]-4-ol
CAS No: 3916-44-7 Catalog No: AG003LUC MDL No:MFCD00047742
Product Description
Catalog Number:
AG003LUC
Chemical Name:
4'-Nitro-[1,1'-biphenyl]-4-ol
CAS Number:
3916-44-7
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
MDL Number:
MFCD00047742
IUPAC Name:
4-(4-nitrophenyl)phenol
InChI:
InChI=1S/C12H9NO3/c14-12-7-3-10(4-8-12)9-1-5-11(6-2-9)13(15)16/h1-8,14H
InChI Key:
ZNDJDQOECGBUNK-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
NSC Number:
95704
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.058g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.208g/mol
Monoisotopic Mass:
215.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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