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18030-95-0 | Imidodicarbonimidic diamide, N-(phenylmethyl)-
CAS No: 18030-95-0 Catalog No: AG0021VX MDL No:MFCD02729228
Product Description
Catalog Number:
AG0021VX
Chemical Name:
Imidodicarbonimidic diamide, N-(phenylmethyl)-
CAS Number:
18030-95-0
Molecular Formula:
C9H13N5
Molecular Weight:
191.2330
MDL Number:
MFCD02729228
IUPAC Name:
2-benzyl-1-(diaminomethylidene)guanidine;hydrochloride
InChI:
InChI=1S/C9H13N5.ClH/c10-8(11)14-9(12)13-6-7-4-2-1-3-5-7;/h1-5H,6H2,(H6,10,11,12,13,14);1H
InChI Key:
AQJYNUYNAIBZPG-UHFFFAOYSA-N
SMILES:
N=C(NC(=N)N)NCc1ccccc1
NSC Number:
20590
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.094g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
227.696g/mol
Monoisotopic Mass:
227.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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