Basic information
- CAS
30590-59-1- Standard SMILES
Cc1ccc2c(c1)CC(C)(C)O2- InChIKey
QAJUPXPUAYVJIB-UHFFFAOYSA-N- Molecular formula
- C11H14O
- Average molar mass
- 162.23 g/mol
- Monoisotopic mass
- 162.10446507
Names & identifiers
- Preferred name
- 2,3-Dihydro-2,2,5-trimethylbenzofuran
- IUPAC
- 2,2,5-trimethyl-3H-1-benzofuran
Names & synonyms
30590-59-1RefChem:2447722,3-Dihydro-2,2,5-trimethylbenzofuranNSC229350NSC 2293502,2,5-trimethyl-2,3-dihydro-1-benzofuranSCHEMBL12035985DTXSID20310613NSC-229350
Database identifiers
- CAS
30590-59-1- PubChem CID
- 313703
- DTXSID
DTXSID20310613- Nikkaji
- J811.916C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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