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188631-87-0 | Guanidine, N-(7-aminoheptyl)-N',N''-dicyclohexyl-
CAS No: 188631-87-0 Catalog No: AG002H2B MDL No:
Product Description
Catalog Number:
AG002H2B
Chemical Name:
Guanidine, N-(7-aminoheptyl)-N',N''-dicyclohexyl-
CAS Number:
188631-87-0
Molecular Formula:
C20H40N4
Molecular Weight:
336.5584
IUPAC Name:
2-(7-aminoheptyl)-1,3-dicyclohexylguanidine
InChI:
InChI=1S/C20H40N4/c21-16-10-2-1-3-11-17-22-20(23-18-12-6-4-7-13-18)24-19-14-8-5-9-15-19/h18-19H,1-17,21H2,(H2,22,23,24)
InChI Key:
SBPYMRNCPAQYHA-UHFFFAOYSA-N
SMILES:
NCCCCCCCNC(=NC1CCCCC1)NC1CCCCC1
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.325g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
336.568g/mol
Monoisotopic Mass:
336.325g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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