Basic information
- CAS
21395-07-3- Standard SMILES
CCC(C)OC(CBr)c1ccc(Cl)cc1- InChIKey
UTCJQORVQSCRJO-UHFFFAOYSA-N- Molecular formula
- C12H16BrClO
- Average molar mass
- 291.61 g/mol
- Monoisotopic mass
- 290.00731
Names & identifiers
- Preferred name
- Ether, alpha-(bromomethyl)-p-chlorobenzyl sec-butyl
- IUPAC
- 1-(2-bromo-1-butan-2-yloxyethyl)-4-chlorobenzene
- English name
- [α-(Bromomethyl)-p-chlorobenzyl]sec-butyl ether
- Molecular formula
- C12H16BrClO
- Molecular weight
- 291.61
Names & synonyms
21395-07-3BRN 2370169alpha-(Bromomethyl)-p-chlorobenzyl sec-butyl etherETHER, alpha-(BROMOMETHYL)-p-CHLOROBENZYL sec-BUTYLRefChem:3415351-[2-bromo-1-(butan-2-yloxy)ethyl]-4-chlorobenzene1-(2-Bromo-1-(sec-butoxy)ethyl)-4-chlorobenzene[alpha-(Bromomethyl)-p-chlorobenzyl]sec-butyl etherDTXSID60943944AKOS011393622CS-0299864EN300-1132971
Show more names
[α-(Bromomethyl)-p-chlorobenzyl]sec-butyl etherBenzene, 1-[2-bromo-1-(1-methylpropoxy)ethyl]-4-chloro-
1-(2-bromo-1-sec-butoxy-ethyl)-4-chloro-benzene1-{2-Bromo-1-[(butan-2-yl)oxy]ethyl}-4-chlorobenzene
Database identifiers
- CAS
21395-07-3- PubChem CID
- 30612
- DTXSID
DTXSID60943944- Nikkaji
- J61.540D
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 169
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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