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Home > Nitro Compounds > 90322-48-8
90322-48-8 | (5-nitro-1-benzofuran-2-yl)methanol
CAS No: 90322-48-8 Catalog No: AG00GVQE MDL No:MFCD10758066
Product Description
Catalog Number:
AG00GVQE
Chemical Name:
(5-nitro-1-benzofuran-2-yl)methanol
CAS Number:
90322-48-8
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
MDL Number:
MFCD10758066
IUPAC Name:
(5-nitro-1-benzofuran-2-yl)methanol
InChI:
InChI=1S/C9H7NO4/c11-5-8-4-6-3-7(10(12)13)1-2-9(6)14-8/h1-4,11H,5H2
InChI Key:
SAIWPSXAGFHMTA-UHFFFAOYSA-N
SMILES:
OCc1cc2c(o1)ccc(c2)[N+](=O)[O-]
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.158g/mol
Monoisotopic Mass:
193.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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