Basic information
- Standard SMILES
CCOc1ccc(C(C)(C)COCc2cccc(Oc3ccccc3)c2)cc1Cl- InChIKey
PLGYQISBTYZBSZ-UHFFFAOYSA-N- Molecular formula
- C25H27ClO3
- Average molar mass
- 410.9 g/mol
- Monoisotopic mass
- 410.1648724
Names & identifiers
- Preferred name
- 3-Chloro-4-ethoxyneophyl 3-phenoxybenzyl ether
- IUPAC
- 2-chloro-1-ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene
- English name
- Benzene, 1-((2-(3-chloro-4-ethoxyphenyl)-2-methylpropoxy)methyl)-3-phe noxy-
- Molecular formula
- C25H27ClO3
- Molecular weight
- 410.93
Names & synonyms
80853-81-2RefChem:10675863-Chloro-4-ethoxyneophyl 3-phenoxybenzyl ether3-Phenoxybenzyl 2-(3-chloro-4-ethoxyphenyl)-2-methylpropyl ether1-((2-(3-Chloro-4-ethoxyphenyl)-2-methylpropoxy)methyl)-3-phenoxybenzeneBenzene, 1-((2-(3-chloro-4-ethoxyphenyl)-2-methylpropoxy)methyl)-3-phenoxy-SCHEMBL9339595PLGYQISBTYZBSZ-UHFFFAOYSA-NDTXSID7010015752-Chloro-1-ethoxy-4-{2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl}benzene4-ethoxy-3-chloroneophyl m-phenoxybenzyl etherBenzene, 1-((2-(3-chloro-4-ethoxyphenyl)-2-methylpropoxy)methyl)-3-phe noxy-
Database identifiers
- CAS
80853-81-2- PubChem CID
- 3067183
- DTXSID
DTXSID701001575- Nikkaji
- J135.052H
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 463
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
11 records
Linked notes
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