Home Carboxys Methyl 6-hydroxy-1,3-benzoxazole-7-carboxylate

Methyl 6-hydroxy-1,3-benzoxazole-7-carboxylate

CAS No.:
155012-54-7
Catalog Number:
AG01DBNE
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
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Product Description
Catalog Number:
AG01DBNE
Chemical Name:
Methyl 6-hydroxy-1,3-benzoxazole-7-carboxylate
CAS Number:
155012-54-7
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
MDL Number:
MFCD28676739
IUPAC Name:
methyl 6-hydroxy-1,3-benzoxazole-7-carboxylate
InChI:
InChI=1S/C9H7NO4/c1-13-9(12)7-6(11)3-2-5-8(7)14-4-10-5/h2-4,11H,1H3
InChI Key:
MQCNSLUZBIIJIR-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(O)ccc2c1ocn2
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.158g/mol
Monoisotopic Mass:
193.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties