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Home > Nitro Compounds > 114184-75-7
114184-75-7 | [1,1'-Biphenyl]ol, methylnitro- (9CI)
CAS No: 114184-75-7 Catalog No: AG000ARI MDL No:
Product Description
Catalog Number:
AG000ARI
Chemical Name:
[1,1'-Biphenyl]ol, methylnitro- (9CI)
CAS Number:
114184-75-7
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
IUPAC Name:
3-methyl-2-nitro-6-phenylphenol
InChI:
InChI=1S/C13H11NO3/c1-9-7-8-11(10-5-3-2-4-6-10)13(15)12(9)14(16)17/h2-8,15H,1H3
InChI Key:
DKGAPOGFCNSXIW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)ccc(c1O)c1ccccc1
Properties
Complexity:
270
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:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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