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Home > Nitro Compounds > 145279-04-5
145279-04-5 | 2-nitro-4-phenoxyphenol
CAS No: 145279-04-5 Catalog No: AG01C7DY MDL No:MFCD27944853
Product Description
Catalog Number:
AG01C7DY
Chemical Name:
2-nitro-4-phenoxyphenol
CAS Number:
145279-04-5
Molecular Formula:
C12H9NO4
Molecular Weight:
231.2042
MDL Number:
MFCD27944853
IUPAC Name:
2-nitro-4-phenoxyphenol
InChI:
InChI=1S/C12H9NO4/c14-12-7-6-10(8-11(12)13(15)16)17-9-4-2-1-3-5-9/h1-8,14H
InChI Key:
PVFPTCXTEHFQGM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1O)Oc1ccccc1
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.053g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.207g/mol
Monoisotopic Mass:
231.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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