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88683-29-8 | Imidodicarbonimidic diamide, N-(3-acetylphenyl)-
CAS No: 88683-29-8 Catalog No: AG0047WC MDL No:
Product Description
Catalog Number:
AG0047WC
Chemical Name:
Imidodicarbonimidic diamide, N-(3-acetylphenyl)-
CAS Number:
88683-29-8
Molecular Formula:
C10H13N5O
Molecular Weight:
219.2431
IUPAC Name:
2-(3-acetylphenyl)-1-(diaminomethylidene)guanidine
InChI:
InChI=1S/C10H13N5O/c1-6(16)7-3-2-4-8(5-7)14-10(13)15-9(11)12/h2-5H,1H3,(H6,11,12,13,14,15)
InChI Key:
DWIJXVOBPSPUSN-UHFFFAOYSA-N
SMILES:
NC(=N)NC(=N)Nc1cccc(c1)C(=O)C
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.112g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
219.248g/mol
Monoisotopic Mass:
219.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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