Basic information
- CAS
55591-12-3- Standard SMILES
CCOC(=O)c1cccc2c1CCC2(C)C- InChIKey
JAWKNTBIAIQVDD-UHFFFAOYSA-N- Molecular formula
- C14H18O2
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.13067981
Names & identifiers
- Preferred name
- Ethyl 1,1-dimethylindan-4-carboxylate
- IUPAC
- ethyl 1,1-dimethyl-2,3-dihydroindene-4-carboxylate
- English name
- 2,3-Dihydro-1,1-dimethyl-1H-indene-4-carboxylic acid ethyl ester
- Molecular formula
- C14H18O2
- Molecular weight
- 218.29
Names & synonyms
55591-12-3Ethyl 1,1-dimethylindan-4-carboxylateethyl 1,1-dimethyl-2,3-dihydro-1H-indene-4-carboxylateDTXSID50204137JAWKNTBIAIQVDD-UHFFFAOYSA-N1H-Indene-4-carboxylic acid, 2,3-dihydro-1,1-dimethyl-, ethyl ester2,3-Dihydro-1,1-dimethyl-1H-indene-4-carboxylic acid ethyl esterEthyl 1,1-dimethyl-4-indanecarboxylate #DB-3130411,1-DIMETHYLINDAN-4-CARBOXYLIC ACID ETHYLESTERQ634089921,1-Dimethylindane-4-carboxylic acid ethyl ester
Database identifiers
- CAS
55591-12-3- PubChem CID
- 41480
- DTXSID
DTXSID50204137- Nikkaji
- J130.724J
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 270
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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