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Home > Nitro Compounds > 149082-03-1
149082-03-1 | 2-Pyridinemethanol, 3,5-dimethyl-4-nitro-
CAS No: 149082-03-1 Catalog No: AG001LD9 MDL No:MFCD03426035
Product Description
Catalog Number:
AG001LD9
Chemical Name:
2-Pyridinemethanol, 3,5-dimethyl-4-nitro-
CAS Number:
149082-03-1
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD03426035
IUPAC Name:
(3,5-dimethyl-4-nitropyridin-2-yl)methanol
InChI:
InChI=1S/C8H10N2O3/c1-5-3-9-7(4-11)6(2)8(5)10(12)13/h3,11H,4H2,1-2H3
InChI Key:
KBCDOXSSYLFMHH-UHFFFAOYSA-N
SMILES:
OCc1ncc(c(c1C)[N+](=O)[O-])C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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