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Home > Nitro Compounds > 181258-27-5
181258-27-5 | Benzenemethanol, α-methyl-2-nitroso-
CAS No: 181258-27-5 Catalog No: AG0022RR MDL No:
Product Description
Catalog Number:
AG0022RR
Chemical Name:
Benzenemethanol, α-methyl-2-nitroso-
CAS Number:
181258-27-5
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
IUPAC Name:
1-(2-nitrosophenyl)ethanol
InChI:
InChI=1S/C8H9NO2/c1-6(10)7-4-2-3-5-8(7)9-11/h2-6,10H,1H3
InChI Key:
NFMDIADQJYVCHE-UHFFFAOYSA-N
SMILES:
O=Nc1ccccc1C(O)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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