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22280-02-0 | 3-Methylpyridin-4-ol
CAS No: 22280-02-0 Catalog No: AG0033R7 MDL No:MFCD04114239
Product Description
Catalog Number:
AG0033R7
Chemical Name:
3-Methylpyridin-4-ol
CAS Number:
22280-02-0
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
MDL Number:
MFCD04114239
IUPAC Name:
3-methyl-1H-pyridin-4-one
InChI:
InChI=1S/C6H7NO/c1-5-4-7-3-2-6(5)8/h2-4H,1H3,(H,7,8)
InChI Key:
RZUBLMCZJPIOPF-UHFFFAOYSA-N
SMILES:
Cc1cnccc1O
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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