Home Other Building Blocks 1-benzyl-2,3,4,5-tetrahydro-1H-1-benzazepin-5-one

1-benzyl-2,3,4,5-tetrahydro-1H-1-benzazepin-5-one

CAS No.:
890839-26-6
Catalog Number:
AG01BRHC
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$303
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Product Description
Catalog Number:
AG01BRHC
Chemical Name:
1-benzyl-2,3,4,5-tetrahydro-1H-1-benzazepin-5-one
CAS Number:
890839-26-6
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
MDL Number:
MFCD30535725
IUPAC Name:
1-benzyl-3,4-dihydro-2H-1-benzazepin-5-one
InChI:
InChI=1S/C17H17NO/c19-17-11-6-12-18(13-14-7-2-1-3-8-14)16-10-5-4-9-15(16)17/h1-5,7-10H,6,11-13H2
InChI Key:
OFPFLFCBMYZAJX-UHFFFAOYSA-N
SMILES:
O=C1CCCN(c2c1cccc2)Cc1ccccc1
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.131g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.329g/mol
Monoisotopic Mass:
251.131g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties