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Home > Nitro Compounds > 17580-64-2
17580-64-2 | 2-[(hydroxyimino)methyl]-6-nitrophenol
CAS No: 17580-64-2 Catalog No: AG019P43 MDL No:MFCD01070626
Product Description
Catalog Number:
AG019P43
Chemical Name:
2-[(hydroxyimino)methyl]-6-nitrophenol
CAS Number:
17580-64-2
Molecular Formula:
C7H6N2O4
Molecular Weight:
182.1335
MDL Number:
MFCD01070626
IUPAC Name:
2-[(E)-hydroxyiminomethyl]-6-nitrophenol
InChI:
InChI=1S/C7H6N2O4/c10-7-5(4-8-11)2-1-3-6(7)9(12)13/h1-4,10-11H/b8-4+
InChI Key:
MTLXRYAXTYRUHQ-XBXARRHUSA-N
SMILES:
ON=Cc1cccc(c1O)[N+](=O)[O-]
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
182.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.135g/mol
Monoisotopic Mass:
182.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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