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101010-25-7 | Guanidine, N-cyclohexyl-N'-phenyl-
CAS No: 101010-25-7 Catalog No: AG0003IG MDL No:
Product Description
Catalog Number:
AG0003IG
Chemical Name:
Guanidine, N-cyclohexyl-N'-phenyl-
CAS Number:
101010-25-7
Molecular Formula:
C13H19N3
Molecular Weight:
217.3101
IUPAC Name:
2-cyclohexyl-1-phenylguanidine
InChI:
InChI=1S/C13H19N3/c14-13(15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H3,14,15,16)
InChI Key:
KSGLRGLKLQWENW-UHFFFAOYSA-N
SMILES:
N=C(Nc1ccccc1)NC1CCCCC1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.158g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.316g/mol
Monoisotopic Mass:
217.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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