Home Halogens Methyl 3-chloro-11-oxo-10,11-dihydro-5h-dibenzo[b,e][1,4]diazepine-7-carboxylate

Methyl 3-chloro-11-oxo-10,11-dihydro-5h-dibenzo[b,e][1,4]diazepine-7-carboxylate

CAS No.:
755034-06-1
Catalog Number:
AG00G3SK
Molecular Formula:
C15H11ClN2O3
Molecular Weight:
302.7124
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$378
- +
250mg
95%
In Stock USA
United States
$630
- +
Product Description
Catalog Number:
AG00G3SK
Chemical Name:
Methyl 3-chloro-11-oxo-10,11-dihydro-5h-dibenzo[b,e][1,4]diazepine-7-carboxylate
CAS Number:
755034-06-1
Molecular Formula:
C15H11ClN2O3
Molecular Weight:
302.7124
MDL Number:
MFCD27991321
IUPAC Name:
methyl 9-chloro-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-2-carboxylate
InChI:
InChI=1S/C15H11ClN2O3/c1-21-15(20)8-2-5-11-13(6-8)17-12-7-9(16)3-4-10(12)14(19)18-11/h2-7,17H,1H3,(H,18,19)
InChI Key:
UDIXIELWVJWCCT-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)[nH]c1cc(Cl)ccc1c(=O)[nH]2
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.046g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
302.714g/mol
Monoisotopic Mass:
302.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties