Home Carboxys 4-Benzoxazolecarboxylic acid, 2-methyl-, methyl ester

4-Benzoxazolecarboxylic acid, 2-methyl-, methyl ester

CAS No.:
128156-55-8
Catalog Number:
AG00HRRL
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00HRRL
Chemical Name:
4-Benzoxazolecarboxylic acid, 2-methyl-, methyl ester
CAS Number:
128156-55-8
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD25978082
IUPAC Name:
methyl 2-methyl-1,3-benzoxazole-4-carboxylate
InChI:
InChI=1S/C10H9NO3/c1-6-11-9-7(10(12)13-2)4-3-5-8(9)14-6/h3-5H,1-2H3
InChI Key:
XDEABWGAOREBSR-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc2c1nc(o2)C
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties