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123638-31-3 | Benzenemethanamine, N-[1-(2-propen-1-yl)cyclohexyl]-
CAS No: 123638-31-3 Catalog No: AG000KWR MDL No:MFCD00757006
Product Description
Catalog Number:
AG000KWR
Chemical Name:
Benzenemethanamine, N-[1-(2-propen-1-yl)cyclohexyl]-
CAS Number:
123638-31-3
Molecular Formula:
C16H23N
Molecular Weight:
229.3605
MDL Number:
MFCD00757006
IUPAC Name:
N-benzyl-1-prop-2-enylcyclohexan-1-amine
InChI:
InChI=1S/C16H23N/c1-2-11-16(12-7-4-8-13-16)17-14-15-9-5-3-6-10-15/h2-3,5-6,9-10,17H,1,4,7-8,11-14H2
InChI Key:
ODYSVFMFOZGGCA-UHFFFAOYSA-N
SMILES:
C=CCC1(NCc2ccccc2)CCCCC1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.183g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.367g/mol
Monoisotopic Mass:
229.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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