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85972-83-4 | 2-Propen-1-amine, 3-cyclohexyl-N,N-dimethyl-3-phenyl-
CAS No: 85972-83-4 Catalog No: AG004QBK MDL No:
Product Description
Catalog Number:
AG004QBK
Chemical Name:
2-Propen-1-amine, 3-cyclohexyl-N,N-dimethyl-3-phenyl-
CAS Number:
85972-83-4
Molecular Formula:
C17H25N
Molecular Weight:
243.3871
IUPAC Name:
3-cyclohexyl-N,N-dimethyl-3-phenylprop-2-en-1-amine
InChI:
InChI=1S/C17H25N/c1-18(2)14-13-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3,5-6,9-10,13,16H,4,7-8,11-12,14H2,1-2H3
InChI Key:
BWNLBLCQPJOXMO-UHFFFAOYSA-N
SMILES:
CN(CC=C(c1ccccc1)C1CCCCC1)C
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.199g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.394g/mol
Monoisotopic Mass:
243.199g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.2
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