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Home Halogens Methyl 7-chloro-2-oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylate

Methyl 7-chloro-2-oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylate

CAS No.:
1301214-59-4
Catalog Number:
AG00HS0M
Molecular Formula:
C9H7ClN2O3
Molecular Weight:
226.6165
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$563
- +
10g
98%
In Stock USA
United States
$982
- +
Product Description
Catalog Number:
AG00HS0M
Chemical Name:
Methyl 7-chloro-2-oxo-1,3-dihydro-1,3-benzodiazole-5-carboxylate
CAS Number:
1301214-59-4
Molecular Formula:
C9H7ClN2O3
Molecular Weight:
226.6165
MDL Number:
MFCD22561313
IUPAC Name:
methyl 7-chloro-2-oxo-1,3-dihydrobenzimidazole-5-carboxylate
InChI:
InChI=1S/C9H7ClN2O3/c1-15-8(13)4-2-5(10)7-6(3-4)11-9(14)12-7/h2-3H,1H3,(H2,11,12,14)
InChI Key:
VUDPLHWTJYVJSR-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)c2c(c1)[nH]c(=O)[nH]2
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.015g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.616g/mol
Monoisotopic Mass:
226.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties