Home Aminos 2-Cyclohexen-1-one, 3-(phenylamino)-

2-Cyclohexen-1-one, 3-(phenylamino)-

CAS No.:
24706-50-1
Catalog Number:
AG002P48
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG002P48
Chemical Name:
2-Cyclohexen-1-one, 3-(phenylamino)-
CAS Number:
24706-50-1
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD00082654
IUPAC Name:
3-anilinocyclohex-2-en-1-one
InChI:
InChI=1S/C12H13NO/c14-12-8-4-7-11(9-12)13-10-5-2-1-3-6-10/h1-3,5-6,9,13H,4,7-8H2
InChI Key:
IVONJXTZXFTWNA-UHFFFAOYSA-N
SMILES:
O=C1CCCC(=C1)Nc1ccccc1
NSC Number:
166087
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties