Basic information
- CAS
21270-14-4- Standard SMILES
CCCCCCOC(CBr)c1ccc(C2CCCCC2)cc1- InChIKey
GIGMFWUAGKVVPT-UHFFFAOYSA-N- Molecular formula
- C20H31BrO
- Average molar mass
- 367.4 g/mol
- Monoisotopic mass
- 366.15583
Names & identifiers
- Preferred name
- Ether, alpha-(bromomethyl)-p-cyclohexylbenzyl hexyl
- IUPAC
- 1-(2-bromo-1-hexoxyethyl)-4-cyclohexylbenzene
- English name
- [α-(Bromomethyl)-p-cyclohexylbenzyl]hexyl ether
- Molecular formula
- C20H31BrO
- Molecular weight
- 367.36
Names & synonyms
BRN 238306421270-14-4alpha-(Bromomethyl)-p-cyclohexylbenzyl hexyl etherETHER, alpha-(BROMOMETHYL)-p-CYCLOHEXYLBENZYL HEXYLRefChem:3415371-[2-bromo-1-(hexyloxy)ethyl]-4-cyclohexylbenzene[alpha-(Bromomethyl)-p-cyclohexylbenzyl]hexyl etherDTXSID20943748[α-(Bromomethyl)-p-cyclohexylbenzyl]hexyl etherBenzene, 1-[2-bromo-1-(hexyloxy)ethyl]-4-cyclohexyl-
Database identifiers
- CAS
21270-14-4- PubChem CID
- 30576
- DTXSID
DTXSID20943748- Nikkaji
- J61.544G
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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