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84812-66-8 | ETHYL 2-(2-METHYL-1-OXOPROPYL)CYCLOHEXANEACETATE
CAS No: 84812-66-8 Catalog No: AG004X3U MDL No:
Product Description
Catalog Number:
AG004X3U
Chemical Name:
ETHYL 2-(2-METHYL-1-OXOPROPYL)CYCLOHEXANEACETATE
CAS Number:
84812-66-8
Molecular Formula:
C14H24O3
Molecular Weight:
240.3386
IUPAC Name:
ethyl 2-[2-(2-methylpropanoyl)cyclohexyl]acetate
InChI:
InChI=1S/C14H24O3/c1-4-17-13(15)9-11-7-5-6-8-12(11)14(16)10(2)3/h10-12H,4-9H2,1-3H3
InChI Key:
UOHCVAKXGKIYPN-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1CCCCC1C(=O)C(C)C
EC Number:
284-209-4
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.343g/mol
Monoisotopic Mass:
240.173g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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