Completing data — usually done within a minute
Basic information
- CAS
57133-55-8- Standard SMILES
CCOC(=O)CC1CCCCC12OCCO2- InChIKey
RQCRKRWTYLZRSX-UHFFFAOYSA-N- Molecular formula
- C12H20O4
- Average molar mass
- 228.28 g/mol
- Monoisotopic mass
- 228.13615912
Names & identifiers
- Preferred name
- 1,4-Dioxaspiro[4.5]decane-6-acetic acid, ethyl ester
- IUPAC
- ethyl 2-(1,4-dioxaspiro[4.5]decan-6-yl)acetate
Names & synonyms
57133-55-8ethyl 2-{1,4-dioxaspiro[4.5]decan-6-yl}acetate1,4-Dioxaspiro[4.5]decane-6-acetic acid, ethyl esterethyl 2-(1,4-dioxaspiro[4.5]decan-6-yl)acetateSCHEMBL3388688DTXSID60340797HCA13355EN300-170390Ethyl 1,4-dioxaspiro[4.5]dec-6-ylacetate #Ethyl (1,4-dioxaspiro[4.5]decan-6-yl)acetateethyl2-{1,4-dioxaspiro[4.5]decan-6-yl}acetate(1,4-dioxaspiro[4.5]dec-6-yl)acetic acid ethyl ester
Show more names
(+/-)-6-(ethoxycarbonylmethyl)-1,4-dioxaspiro[4.5]decane
Database identifiers
- CAS
57133-55-8- PubChem CID
- 567526
- DTXSID
DTXSID60340797
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
Related reactions
3 records
Compound notes
Loading…