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18358-56-0 | Cyclobutaneacetic acid, 3-ethyl-2,2-dimethyl-, methyl ester
CAS No: 18358-56-0 Catalog No: AG0027PZ MDL No:
Product Description
Catalog Number:
AG0027PZ
Chemical Name:
Cyclobutaneacetic acid, 3-ethyl-2,2-dimethyl-, methyl ester
CAS Number:
18358-56-0
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
IUPAC Name:
methyl 2-(3-ethyl-2,2-dimethylcyclobutyl)acetate
InChI:
InChI=1S/C11H20O2/c1-5-8-6-9(11(8,2)3)7-10(12)13-4/h8-9H,5-7H2,1-4H3
InChI Key:
REYSPUYGLFIXIY-UHFFFAOYSA-N
SMILES:
CCC1CC(C1(C)C)CC(=O)OC
NSC Number:
96758
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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