Home Carboxys Methyl benzo[d]oxazole-7-carboxylate

Methyl benzo[d]oxazole-7-carboxylate

CAS No.:
1086378-35-9
Catalog Number:
AG0095W7
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥95%
In Stock USA
United States
$186
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Product Description
Catalog Number:
AG0095W7
Chemical Name:
Methyl benzo[d]oxazole-7-carboxylate
CAS Number:
1086378-35-9
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD11042246
IUPAC Name:
methyl 1,3-benzoxazole-7-carboxylate
InChI:
InChI=1S/C9H7NO3/c1-12-9(11)6-3-2-4-7-8(6)13-5-10-7/h2-5H,1H3
InChI Key:
SVWYSYMOKICPBK-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc2c1ocn2
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties