Home Halogens methyl 3-(2-chlorophenyl)-5-ethyl-1,2-oxazole-4-carboxylate

methyl 3-(2-chlorophenyl)-5-ethyl-1,2-oxazole-4-carboxylate

CAS No.:
1803595-38-1
Catalog Number:
AG01BGGF
Molecular Formula:
C13H12ClNO3
Molecular Weight:
265.6923
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Product Description
Catalog Number:
AG01BGGF
Chemical Name:
methyl 3-(2-chlorophenyl)-5-ethyl-1,2-oxazole-4-carboxylate
CAS Number:
1803595-38-1
Molecular Formula:
C13H12ClNO3
Molecular Weight:
265.6923
MDL Number:
MFCD28125122
IUPAC Name:
methyl 3-(2-chlorophenyl)-5-ethyl-1,2-oxazole-4-carboxylate
InChI:
InChI=1S/C13H12ClNO3/c1-3-10-11(13(16)17-2)12(15-18-10)8-6-4-5-7-9(8)14/h4-7H,3H2,1-2H3
InChI Key:
OCUQLCSWRBFRAG-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(CC)onc1c1ccccc1Cl
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.051g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.693g/mol
Monoisotopic Mass:
265.051g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties