Home Carboxys methyl 6-methoxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate

methyl 6-methoxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate

CAS No.:
1388063-51-1
Catalog Number:
AG01AFI2
Molecular Formula:
C10H10N2O4
Molecular Weight:
222.1974
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Product Description
Catalog Number:
AG01AFI2
Chemical Name:
methyl 6-methoxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylate
CAS Number:
1388063-51-1
Molecular Formula:
C10H10N2O4
Molecular Weight:
222.1974
MDL Number:
MFCD22562234
IUPAC Name:
methyl 6-methoxy-2-oxo-1,3-dihydrobenzimidazole-5-carboxylate
InChI:
InChI=1S/C10H10N2O4/c1-15-8-4-7-6(11-10(14)12-7)3-5(8)9(13)16-2/h3-4H,1-2H3,(H2,11,12,14)
InChI Key:
OXXOGCYVOOIVSZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2[nH]c(=O)[nH]c2cc1OC
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