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Home > Pyridines > 122805-63-4
122805-63-4 | Carbonic dihydrazide, [1-(6-acetyl-2-pyridinyl)ethylidene]- (9CI)
CAS No: 122805-63-4 Catalog No: AG000JJ6 MDL No:
Product Description
Catalog Number:
AG000JJ6
Chemical Name:
Carbonic dihydrazide, [1-(6-acetyl-2-pyridinyl)ethylidene]- (9CI)
CAS Number:
122805-63-4
Molecular Formula:
C10H13N5O2
Molecular Weight:
235.2425
IUPAC Name:
1-[1-(6-acetylpyridin-2-yl)ethylideneamino]-3-aminourea
InChI:
InChI=1S/C10H13N5O2/c1-6(14-15-10(17)13-11)8-4-3-5-9(12-8)7(2)16/h3-5H,11H2,1-2H3,(H2,13,15,17)
InChI Key:
AFYLSJDVBRGQFV-UHFFFAOYSA-N
SMILES:
CC(=NNC(=O)NN)c1cccc(n1)C(=O)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.107g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
235.247g/mol
Monoisotopic Mass:
235.107g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.2
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