Chemical ID: 6660144

CCOC(=O)CC1CCCC1
Chemical ID:
6660144
Name [?]:
ethyl 2-cyclopentylacetate
SMILES [?]:
CCOC(=O)CC1CCCC1
InChi [?]:
InChI=1/C9H16O2/c1-2-11-9(10)7-8-5-3-4-6-8/h8H,2-7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,9,10,8,11,6,7,4,5,3/E:(3,4)(5,6)/rA:11nCCOCOCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s7s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H16O2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.98425
Area:336.02
Solvation:-1.41624
Coulombic:-18.9327
Bond Count [?]
All:11
Single:10
Double:1
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:156.222
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.79
LogP (Chemaxon):1.85

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue