Basic information
- CAS
68992-06-3- Standard SMILES
CCOC(=O)C1CCC2C3CCC(C3)C12- InChIKey
LINAHFPJENQYPB-UHFFFAOYSA-N- Molecular formula
- C13H20O2
- Average molar mass
- 208.3 g/mol
- Monoisotopic mass
- 208.14632988
Names & identifiers
- Preferred name
- 4,7-Methano-1H-indene-1-carboxylic acid, octahydro-, ethyl ester
- IUPAC
- ethyl tricyclo[5.2.1.02,6]decane-3-carboxylate
- English name
- Octahydro-4,7-methano-1H-indene-1-carboxylic acid ethyl ester
- Molecular formula
- C13H20O2
- Molecular weight
- 208.3
Names & synonyms
68992-06-34,7-Methano-1H-indene-1-carboxylic acid, octahydro-, ethyl ester4,7-Methanoindan-1-carboxylic acid, hexahydro-, ethyl esterDTXSID30887644RefChem:508316DTXCID801026932LINAHFPJENQYPB-UHFFFAOYSA-NEthyl octahydro-1H-4,7-methanoindene-1-carboxylate4,7-Endomethylen-hydrindancarbonsaeure-(1)-ethylesterOctahydro-4,7-methano-1H-indene-1-carboxylic acid ethyl ester
Database identifiers
- CAS
68992-06-3- PubChem CID
- 112136
- DTXSID
DTXSID30887644- Nikkaji
- J441.282F
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- EPA Substance Registry System
- 4 · 4,7-Methano-1H-indene-1-carboxylic acid, octahydro-, ethyl ester (68992-06-3)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4,7-Methano-1H-indene-1-carboxylic acid, octahydro-, ethyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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