Ether, alpha-(bromomethyl)-p-cyclohexylbenzyl pentyl
Basic information
- CAS
21270-13-3- Standard SMILES
CCCCCOC(CBr)c1ccc(C2CCCCC2)cc1- InChIKey
SSJKEEXKEAHLTD-UHFFFAOYSA-N- Molecular formula
- C19H29BrO
- Average molar mass
- 353.3 g/mol
- Monoisotopic mass
- 352.14018
Names & identifiers
- Preferred name
- Ether, alpha-(bromomethyl)-p-cyclohexylbenzyl pentyl
- IUPAC
- 1-(2-bromo-1-pentoxyethyl)-4-cyclohexylbenzene
- English name
- [α-(Bromomethyl)-p-cyclohexylbenzyl]pentyl ether
- Molecular formula
- C19H29BrO
- Molecular weight
- 353.34
Names & synonyms
BRN 238166421270-13-3alpha-(Bromomethyl)-p-cyclohexylbenzyl pentyl etherETHER, alpha-(BROMOMETHYL)-p-CYCLOHEXYLBENZYL PENTYLRefChem:341539[alpha-(Bromomethyl)-p-cyclohexylbenzyl]pentyl ether1-[2-Bromo-1-(pentyloxy)ethyl]-4-cyclohexylbenzeneDTXSID60943747[α-(Bromomethyl)-p-cyclohexylbenzyl]pentyl etherBenzene, 1-[2-bromo-1-(pentyloxy)ethyl]-4-cyclohexyl-
Database identifiers
- CAS
21270-13-3- PubChem CID
- 30575
- DTXSID
DTXSID60943747- Nikkaji
- J61.546C
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 254
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Compound notes
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