Home Halogens Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate

Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate

CAS No.:
1065074-27-2
Catalog Number:
AG003RWG
Molecular Formula:
C11H8ClNO3
Molecular Weight:
237.6391
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG003RWG
Chemical Name:
Methyl 5-(3-chlorophenyl)isoxazole-4-carboxylate
CAS Number:
1065074-27-2
Molecular Formula:
C11H8ClNO3
Molecular Weight:
237.6391
MDL Number:
MFCD11504883
IUPAC Name:
methyl 5-(3-chlorophenyl)-1,2-oxazole-4-carboxylate
InChI:
InChI=1S/C11H8ClNO3/c1-15-11(14)9-6-13-16-10(9)7-3-2-4-8(12)5-7/h2-6H,1H3
InChI Key:
IQMQZQIJFOAHQN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnoc1c1cccc(c1)Cl
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.019g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.639g/mol
Monoisotopic Mass:
237.019g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties