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Home > Pyridines > 1184096-11-4
1184096-11-4 | 6-chloro-N-(prop-2-yn-1-yl)pyridazine-3-carboxamide
CAS No: 1184096-11-4 Catalog No: AG01BRNC MDL No:MFCD12165839
Product Description
Catalog Number:
AG01BRNC
Chemical Name:
6-chloro-N-(prop-2-yn-1-yl)pyridazine-3-carboxamide
CAS Number:
1184096-11-4
Molecular Formula:
C8H6ClN3O
Molecular Weight:
195.6057
MDL Number:
MFCD12165839
IUPAC Name:
6-chloro-N-prop-2-ynylpyridazine-3-carboxamide
InChI:
InChI=1S/C8H6ClN3O/c1-2-5-10-8(13)6-3-4-7(9)12-11-6/h1,3-4H,5H2,(H,10,13)
InChI Key:
DAAHYUAQXZPPLV-UHFFFAOYSA-N
SMILES:
Clc1ccc(nn1)C(=O)NCC#C
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.606g/mol
Monoisotopic Mass:
195.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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