Home Halogens Ethyl 5-(chloromethyl)isoxazole-3-carboxylate

Ethyl 5-(chloromethyl)isoxazole-3-carboxylate

CAS No.:
3209-40-3
Catalog Number:
AG00CMSX
Molecular Formula:
C7H8ClNO3
Molecular Weight:
189.5963
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$38
- +
250mg
95%
In Stock USA
United States
$74
- +
1g
95%
In Stock USA
United States
$147
- +
Product Description
Catalog Number:
AG00CMSX
Chemical Name:
Ethyl 5-(chloromethyl)isoxazole-3-carboxylate
CAS Number:
3209-40-3
Molecular Formula:
C7H8ClNO3
Molecular Weight:
189.5963
MDL Number:
MFCD08445409
IUPAC Name:
ethyl 5-(chloromethyl)-1,2-oxazole-3-carboxylate
InChI:
InChI=1S/C7H8ClNO3/c1-2-11-7(10)6-3-5(4-8)12-9-6/h3H,2,4H2,1H3
InChI Key:
RNURPQMTRDHCNM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1noc(c1)CCl
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.019g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.595g/mol
Monoisotopic Mass:
189.019g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties