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100747-79-3

100747-79-3 | Benzenamine, N-(2-methyl-1-cyclohexen-1-yl)-N-2-propen-1-yl-

CAS No: 100747-79-3 Catalog No: AG0002RS MDL No:

Product Description

Catalog Number:
AG0002RS
Chemical Name:
Benzenamine, N-(2-methyl-1-cyclohexen-1-yl)-N-2-propen-1-yl-
CAS Number:
100747-79-3
Molecular Formula:
C16H21N
Molecular Weight:
227.3446
IUPAC Name:
N-(2-methylcyclohexen-1-yl)-N-prop-2-enylaniline
InChI:
InChI=1S/C16H21N/c1-3-13-17(15-10-5-4-6-11-15)16-12-8-7-9-14(16)2/h3-6,10-11H,1,7-9,12-13H2,2H3
InChI Key:
MYANDWIXPDHXLD-UHFFFAOYSA-N
SMILES:
C=CCN(C1=C(C)CCCC1)c1ccccc1

Properties

Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.167g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.351g/mol
Monoisotopic Mass:
227.167g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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