Home Other Building Blocks N-Benzoyl-4-perhydroazepinone

N-Benzoyl-4-perhydroazepinone

CAS No.:
15923-40-7
Catalog Number:
AG001QL0
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%(GC)
In Stock USA
United States
$226
- +
1g
98%(GC)
In Stock USA
United States
$530
- +
5g
98%(GC)
In Stock USA
United States
$1394
- +
Product Description
Catalog Number:
AG001QL0
Chemical Name:
N-Benzoyl-4-perhydroazepinone
CAS Number:
15923-40-7
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
MDL Number:
MFCD06412563
IUPAC Name:
1-benzoylazepan-4-one
InChI:
InChI=1S/C13H15NO2/c15-12-7-4-9-14(10-8-12)13(16)11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2
InChI Key:
CFZRTDHGRHTNHP-UHFFFAOYSA-N
SMILES:
O=C1CCCN(CC1)C(=O)c1ccccc1
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties