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143771-78-2 | 2-Oxiranecarboxylic acid, 2-(cyclohexylmethyl)-, ethyl ester
CAS No: 143771-78-2 Catalog No: AG001ICX MDL No:
Product Description
Catalog Number:
AG001ICX
Chemical Name:
2-Oxiranecarboxylic acid, 2-(cyclohexylmethyl)-, ethyl ester
CAS Number:
143771-78-2
Molecular Formula:
C12H20O3
Molecular Weight:
212.2854
IUPAC Name:
ethyl 2-(cyclohexylmethyl)oxirane-2-carboxylate
InChI:
InChI=1S/C12H20O3/c1-2-14-11(13)12(9-15-12)8-10-6-4-3-5-7-10/h10H,2-9H2,1H3
InChI Key:
DANOIPZHDMTQNL-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(OC1)CC1CCCCC1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.141g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.289g/mol
Monoisotopic Mass:
212.141g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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