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Home > Nitro Compounds > 161368-67-8
161368-67-8 | BENZENEMETHANOL, 5-HYDROXY-2-NITROSO-
CAS No: 161368-67-8 Catalog No: AG001SEE MDL No:
Product Description
Catalog Number:
AG001SEE
Chemical Name:
BENZENEMETHANOL, 5-HYDROXY-2-NITROSO-
CAS Number:
161368-67-8
Molecular Formula:
C7H7NO3
Molecular Weight:
153.1354
IUPAC Name:
3-(hydroxymethyl)-4-nitrosophenol
InChI:
InChI=1S/C7H7NO3/c9-4-5-3-6(10)1-2-7(5)8-11/h1-3,9-10H,4H2
InChI Key:
GGOLBXYMRAWBID-UHFFFAOYSA-N
SMILES:
OCc1cc(O)ccc1N=O
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
153.137g/mol
Monoisotopic Mass:
153.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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