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Home > Nitro Compounds > 74683-21-9
74683-21-9 | Phenol, 3-(2-nitrophenoxy)-
CAS No: 74683-21-9 Catalog No: AG005A6A MDL No:MFCD13159459
Product Description
Catalog Number:
AG005A6A
Chemical Name:
Phenol, 3-(2-nitrophenoxy)-
CAS Number:
74683-21-9
Molecular Formula:
C12H9NO4
Molecular Weight:
231.2042
MDL Number:
MFCD13159459
IUPAC Name:
3-(2-nitrophenoxy)phenol
InChI:
InChI=1S/C12H9NO4/c14-9-4-3-5-10(8-9)17-12-7-2-1-6-11(12)13(15)16/h1-8,14H
InChI Key:
RQEKVVMGRXBZPZ-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)Oc1ccccc1[N+](=O)[O-]
Properties
Complexity:
266
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:
2.9
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