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Home > Pyridines > 205744-83-8
205744-83-8 | 3(2H)-Pyridazinone, 4,5-dihydro-6-methyl-, hydrate (1:?)
CAS No: 205744-83-8 Catalog No: AG002AB1 MDL No:MFCD00149420
Product Description
Catalog Number:
AG002AB1
Chemical Name:
3(2H)-Pyridazinone, 4,5-dihydro-6-methyl-, hydrate (1:?)
CAS Number:
205744-83-8
Molecular Formula:
C5H10N2O2
Molecular Weight:
130.1451
MDL Number:
MFCD00149420
IUPAC Name:
3-methyl-4,5-dihydro-1H-pyridazin-6-one;hydrate
InChI:
InChI=1S/C5H8N2O.H2O/c1-4-2-3-5(8)7-6-4;/h2-3H2,1H3,(H,7,8);1H2
InChI Key:
IYLPVOLORPNMJZ-UHFFFAOYSA-N
SMILES:
CC1=NNC(=O)CC1.O
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.074g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
130.147g/mol
Monoisotopic Mass:
130.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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