Home Aminos 3-(Benzylamino)cyclohex-2-en-1-one

3-(Benzylamino)cyclohex-2-en-1-one

CAS No.:
41609-04-5
Catalog Number:
AG01EVVV
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$482
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Product Description
Catalog Number:
AG01EVVV
Chemical Name:
3-(Benzylamino)cyclohex-2-en-1-one
CAS Number:
41609-04-5
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
MDL Number:
MFCD00129506
IUPAC Name:
3-(benzylamino)cyclohex-2-en-1-one
InChI:
InChI=1S/C13H15NO/c15-13-8-4-7-12(9-13)14-10-11-5-2-1-3-6-11/h1-3,5-6,9,14H,4,7-8,10H2
InChI Key:
WORGYPKHYQCAFZ-UHFFFAOYSA-N
SMILES:
O=C1CCCC(=C1)NCc1ccccc1
NSC Number:
264027
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.269g/mol
Monoisotopic Mass:
201.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties