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Home > Nitro Compounds > 63512-41-4
63512-41-4 | sodium 4-nitroresorcinolate
CAS No: 63512-41-4 Catalog No: AG00F60F MDL No:
Product Description
Catalog Number:
AG00F60F
Chemical Name:
sodium 4-nitroresorcinolate
CAS Number:
63512-41-4
IUPAC Name:
sodium;5-hydroxy-2-nitrophenolate
InChI:
InChI=1S/C6H5NO4.Na/c8-4-1-2-5(7(10)11)6(9)3-4;/h1-3,8-9H;/q;+1/p-1
InChI Key:
ICASRMAOWIPHRV-UHFFFAOYSA-M
EC Number:
264-283-4
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.091g/mol
Monoisotopic Mass:
177.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
89.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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