sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys benzyl 5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxylate

benzyl 5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxylate

CAS No.:
1904593-70-9
Catalog Number:
AG01DW38
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DW38
Chemical Name:
benzyl 5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxylate
CAS Number:
1904593-70-9
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
MDL Number:
MFCD31616062
IUPAC Name:
benzyl 5-oxo-3,4-dihydro-2H-1-benzazepine-1-carboxylate
InChI:
InChI=1S/C18H17NO3/c20-17-11-6-12-19(16-10-5-4-9-15(16)17)18(21)22-13-14-7-2-1-3-8-14/h1-5,7-10H,6,11-13H2
InChI Key:
CJASUXANQFOZOL-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(=O)c2c1cccc2)OCc1ccccc1
Properties
Complexity:
403  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.121g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.338g/mol
Monoisotopic Mass:
295.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties