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114898-96-3 | Guanidine, N-cyano-N'-(hexahydro-1-methyl-2H-azepin-2-ylidene)-
CAS No: 114898-96-3 Catalog No: AG000FF8 MDL No:MFCD01724307
Product Description
Catalog Number:
AG000FF8
Chemical Name:
Guanidine, N-cyano-N'-(hexahydro-1-methyl-2H-azepin-2-ylidene)-
CAS Number:
114898-96-3
Molecular Formula:
C9H15N5
Molecular Weight:
193.2489
MDL Number:
MFCD01724307
IUPAC Name:
2-cyano-1-(1-methylazepan-2-ylidene)guanidine
InChI:
InChI=1S/C9H15N5/c1-14-6-4-2-3-5-8(14)13-9(11)12-7-10/h2-6H2,1H3,(H2,11,12)
InChI Key:
GLVRWKUIUSZEBJ-UHFFFAOYSA-N
SMILES:
N#CNC(=N)N=C1CCCCCN1C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.133g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.254g/mol
Monoisotopic Mass:
193.133g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.3
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