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80638-40-0 | 1,3-Propanediamine, N-cyclohexyl-N'-[3-(cyclohexylamino)propyl]-
CAS No: 80638-40-0 Catalog No: AG005KEA MDL No:
Product Description
Catalog Number:
AG005KEA
Chemical Name:
1,3-Propanediamine, N-cyclohexyl-N'-[3-(cyclohexylamino)propyl]-
CAS Number:
80638-40-0
Molecular Formula:
C18H37N3
Molecular Weight:
295.5065
IUPAC Name:
N'-cyclohexyl-N-[3-(cyclohexylamino)propyl]propane-1,3-diamine
InChI:
InChI=1S/C18H37N3/c1-3-9-17(10-4-1)20-15-7-13-19-14-8-16-21-18-11-5-2-6-12-18/h17-21H,1-16H2
InChI Key:
HIOFZSRVLSMAQT-UHFFFAOYSA-N
SMILES:
N(CCCNC1CCCCC1)CCCNC1CCCCC1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.299g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
295.515g/mol
Monoisotopic Mass:
295.299g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
36.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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