200,000+ products from a single source!
sales@angenechem.com
64157-12-6 | 3(6H)-Pyridinone, 4,5-bis(hydroxymethyl)-6-imino-2-methyl-
CAS No: 64157-12-6 Catalog No: AG00H93N MDL No:
Product Description
Catalog Number:
AG00H93N
Chemical Name:
3(6H)-Pyridinone, 4,5-bis(hydroxymethyl)-6-imino-2-methyl-
CAS Number:
64157-12-6
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
IUPAC Name:
4,5-bis(hydroxymethyl)-6-imino-2-methylpyridin-3-one
InChI:
InChI=1S/C8H10N2O3/c1-4-7(13)5(2-11)6(3-12)8(9)10-4/h9,11-12H,2-3H2,1H3
InChI Key:
AHSYDBOXXFAPLL-UHFFFAOYSA-N
SMILES:
OCC1=C(CO)C(=N)N=C(C1=O)C
Properties
Complexity:
328
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:
3
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.