Basic information
- CAS
17299-35-3- Standard SMILES
CC(C)(C)C1=CC(=O)CCC1- InChIKey
MGDNXRBGKVBLEI-UHFFFAOYSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Names & identifiers
- Preferred name
- 3-Tert-butylcyclohex-2-en-1-one
- IUPAC
- 3-tert-butylcyclohex-2-en-1-one
- English name
- 3-tert-butylcyclohex-2-en-1-one
- Molecular formula
- C10H16O
- Molecular weight
- 152.23
Names & synonyms
3-tert-butylcyclohex-2-en-1-one17299-35-3DTXSID30286133RefChem:282697DTXCID502372833-(tert-Butyl)cyclohex-2-en-1-oneNSC438943-t-butyl-2-cyclohexenoneSCHEMBL2600388NSC-43894AKOS0145059243-(1,1-dimethylethyl)-2-Cyclohexen-1-one
Show more names
2-Cyclohexen-1-one, 3-(1,1-dimethylethyl)-
Database identifiers
- CAS
17299-35-3- PubChem CID
- 239097
- DTXSID
DTXSID30286133- Nikkaji
- J569.758A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 193
Chemistry & industry
Suppliers1 total
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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