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14187-25-8 | 2,6-Pyridinedimethanol, 3-hydroxy-, hydrochloride (1:1)
CAS No: 14187-25-8 Catalog No: AG001HAG MDL No:
Product Description
Catalog Number:
AG001HAG
Chemical Name:
2,6-Pyridinedimethanol, 3-hydroxy-, hydrochloride (1:1)
CAS Number:
14187-25-8
Molecular Formula:
C7H10ClNO3
Molecular Weight:
191.6122
IUPAC Name:
2,6-bis(hydroxymethyl)pyridin-3-ol;hydrochloride
InChI:
InChI=1S/C7H9NO3.ClH/c9-3-5-1-2-7(11)6(4-10)8-5;/h1-2,9-11H,3-4H2;1H
InChI Key:
VHNMNLDSAYYRHC-UHFFFAOYSA-N
SMILES:
OCc1ccc(c(n1)CO)O.Cl
NSC Number:
89708
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
191.611g/mol
Monoisotopic Mass:
191.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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