Chemical ID: 5098951

CCOC(=O)CC1CC(C1(C)C)C(C)O
Chemical ID:
5098951
Name [?]:
ethyl 2-[3-(1-hydroxyethyl)-2,2-dimethyl-cyclobutyl]acetate
SMILES [?]:
CCOC(=O)CC1CC(C1(C)C)C(C)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H22O3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:3
ZAP Information [?]
Total:7.74977
Area:414.181
Solvation:-2.60476
Coulombic:-35.4803
Bond Count [?]
All:15
Single:14
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:214.301
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.33
LogP (Chemaxon):1.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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