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23372-17-0 | 4-(hydroxymethyl)-5,6-dimethylpyridazin-3-ol
CAS No: 23372-17-0 Catalog No: AG01B8VN MDL No:MFCD28505687
Product Description
Catalog Number:
AG01B8VN
Chemical Name:
4-(hydroxymethyl)-5,6-dimethylpyridazin-3-ol
CAS Number:
23372-17-0
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
MDL Number:
MFCD28505687
IUPAC Name:
5-(hydroxymethyl)-3,4-dimethyl-1H-pyridazin-6-one
InChI:
InChI=1S/C7H10N2O2/c1-4-5(2)8-9-7(11)6(4)3-10/h10H,3H2,1-2H3,(H,9,11)
InChI Key:
CRBUPQRGYOXAPS-UHFFFAOYSA-N
SMILES:
OCc1c(O)nnc(c1C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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