Home Carboxys methyl 4-methoxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate

methyl 4-methoxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate

CAS No.:
1388030-17-8
Catalog Number:
AG01ACMR
Molecular Formula:
C10H10N2O4
Molecular Weight:
222.1974
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Product Description
Catalog Number:
AG01ACMR
Chemical Name:
methyl 4-methoxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate
CAS Number:
1388030-17-8
Molecular Formula:
C10H10N2O4
Molecular Weight:
222.1974
MDL Number:
MFCD22562143
IUPAC Name:
methyl 4-methoxy-2-oxo-1,3-dihydrobenzimidazole-5-carboxylate
InChI:
InChI=1S/C10H10N2O4/c1-15-8-5(9(13)16-2)3-4-6-7(8)12-10(14)11-6/h3-4H,1-2H3,(H2,11,12,14)
InChI Key:
GIYCBOOSSVUHDL-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1OC)[nH]c(=O)[nH]2
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
222.2g/mol
Monoisotopic Mass:
222.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties