Basic information
- CAS
61886-39-3- Standard SMILES
CC(C)Oc1ccc(OC(C)C)c(Cl)c1- InChIKey
KHJPWDHXQSXQRM-UHFFFAOYSA-N- Molecular formula
- C12H17ClO2
- Average molar mass
- 228.71 g/mol
- Monoisotopic mass
- 228.0917075
Names & identifiers
- Preferred name
- 2-Chloro-1,4-bis(1-methylethoxy)benzene
- IUPAC
- 2-chloro-1,4-di(propan-2-yloxy)benzene
- English name
- 2-chloro-1,4-bis(1-methylethoxy)benzene
- Molecular formula
- C12H17ClO2
- Molecular weight
- 228.72
Names & synonyms
2-chloro-1,4-diisopropoxybenzeneBenzene, 2-chloro-1,4-bis(1-methylethoxy)-2-Chloro-1,4-bis(1-methylethoxy)benzeneSYH7LC5UGQ2-chloro-1,4-di(propan-2-yloxy)benzeneDTXSID8069517RefChem:197716DTXCID304315861886-39-3EINECS 263-289-4UNII-SYH7LC5UGQSCHEMBL19612249
Show more names
2-CHLORO-PARA-DIISOPROPOXYBENZENE
KHJPWDHXQSXQRM-UHFFFAOYSA-NDB-302920NS000348272-Chloro-1,4-bis[(propan-2-yl)oxy]benzene
Database identifiers
- CAS
61886-39-3- PubChem CID
- 112764
- DTXSID
DTXSID8069517- UNII
- SYH7LC5UGQ
- EC Number
- 263-289-4
- Nikkaji
- J32.093E
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- FDA UNII
- 7 LC5UGQ · SYH7LC5UGQ
- EPA Substance Registry System
- 2 · Benzene, 2-chloro-1,4-bis(1-methylethoxy)- (61886-39-3)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 2-chloro-1,4-bis(1-methylethoxy)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…