Home Halogens Ethyl 2-chloro-4-methyloxazole-5-carboxylate

Ethyl 2-chloro-4-methyloxazole-5-carboxylate

CAS No.:
78451-11-3
Catalog Number:
AG00G83F
Molecular Formula:
C7H8ClNO3
Molecular Weight:
189.5963
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Product Description
Catalog Number:
AG00G83F
Chemical Name:
Ethyl 2-chloro-4-methyloxazole-5-carboxylate
CAS Number:
78451-11-3
Molecular Formula:
C7H8ClNO3
Molecular Weight:
189.5963
MDL Number:
MFCD12031294
IUPAC Name:
ethyl 2-chloro-4-methyl-1,3-oxazole-5-carboxylate
InChI:
InChI=1S/C7H8ClNO3/c1-3-11-6(10)5-4(2)9-7(8)12-5/h3H2,1-2H3
InChI Key:
STXSAAHINIUMBV-UHFFFAOYSA-N
SMILES:
Cc1nc(oc1C(=O)OCC)Cl
Properties
Complexity:
176  
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:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties