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100367-79-1 | Acetamide, N-(6-chloro-2,3-dihydro-3-oxo-4-pyridazinyl)-
CAS No: 100367-79-1 Catalog No: AG0001QH MDL No:
Product Description
Catalog Number:
AG0001QH
Chemical Name:
Acetamide, N-(6-chloro-2,3-dihydro-3-oxo-4-pyridazinyl)-
CAS Number:
100367-79-1
Molecular Formula:
C6H6ClN3O2
Molecular Weight:
187.5837
IUPAC Name:
N-(3-chloro-6-oxo-1H-pyridazin-5-yl)acetamide
InChI:
InChI=1S/C6H6ClN3O2/c1-3(11)8-4-2-5(7)9-10-6(4)12/h2H,1H3,(H,10,12)(H,8,9,11)
InChI Key:
ZDEFSKDYTNDZMT-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(Cl)n[nH]c1=O
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
187.583g/mol
Monoisotopic Mass:
187.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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