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21071-04-5 | 2,4-PYRIDINEDIMETHANOL
CAS No: 21071-04-5 Catalog No: AG002KXE MDL No:MFCD11617173
Product Description
Catalog Number:
AG002KXE
Chemical Name:
2,4-PYRIDINEDIMETHANOL
CAS Number:
21071-04-5
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
MDL Number:
MFCD11617173
IUPAC Name:
[2-(hydroxymethyl)pyridin-4-yl]methanol
InChI:
InChI=1S/C7H9NO2/c9-4-6-1-2-8-7(3-6)5-10/h1-3,9-10H,4-5H2
InChI Key:
RPJOPOIUCLTJPN-UHFFFAOYSA-N
SMILES:
OCc1ccnc(c1)CO
Properties
Complexity:
97.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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