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827028-62-6 | 4-Oxazolecarboxylic acid, 5-cyclohexyl-, methyl ester
CAS No: 827028-62-6 Catalog No: AG004WDZ MDL No:
Product Description
Catalog Number:
AG004WDZ
Chemical Name:
4-Oxazolecarboxylic acid, 5-cyclohexyl-, methyl ester
CAS Number:
827028-62-6
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
IUPAC Name:
methyl 5-cyclohexyl-1,3-oxazole-4-carboxylate
InChI:
InChI=1S/C11H15NO3/c1-14-11(13)9-10(15-7-12-9)8-5-3-2-4-6-8/h7-8H,2-6H2,1H3
InChI Key:
LUXOGRPJMFCERM-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncoc1C1CCCCC1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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