Basic information
- CAS
5904-85-8- Standard SMILES
CC(C)(C)CC(C)(C)c1ccc(OCC2CO2)cc1- InChIKey
ZYUNNPAOYLRRFE-UHFFFAOYSA-N- Molecular formula
- C17H26O2
- Average molar mass
- 262.4 g/mol
- Monoisotopic mass
- 262.19328007
Names & identifiers
- Preferred name
- 2-{[4-(1,1,3,3-Tetramethylbutyl)phenoxy]methyl}oxirane
- IUPAC
- 2-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]oxirane
- English name
- 2-{[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]METHYL}OXIRANE
- Molecular formula
- C17H26O2
- Molecular weight
- 262.39
Names & synonyms
5904-85-82-{[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl}oxirane2-((4-(2,4,4-Trimethylpentan-2-yl)phenoxy)methyl)oxirane2-[4-(2,4,4-trimethylpentan-2-yl)phenoxymethyl]oxirane2-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]oxirane2-{[4-(2,4,4-Trimethylpentan-2-yl)phenoxy]methyl}oxirane2-[[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]oxiraneSCHEMBL3134462DTXSID30406672ZYUNNPAOYLRRFE-UHFFFAOYSA-NFAA90485AKOS000122850
Show more names
Oxirane, 2-[[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]-
AKOS016889131DB-104091CS-0231688EN300-10946Z945987032-(4-(1,1,3,3-tetramethyl-butyl)-phenoxymethyl)-oxirane
Database identifiers
- CAS
5904-85-8- PubChem CID
- 4868346
- DTXSID
DTXSID30406672
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 282
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers2 total
上海源叶生物科技有限公司13636370518 · [email protected]
郑州睿科生化科技有限公司18521304688;17324816296 · [email protected]
Related reactions
1 records
Compound notes
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