(1-Methylethoxy)benzene
Basic information
- CAS
2741-16-4- Standard SMILES
CC(C)Oc1ccccc1- InChIKey
ZYNMJJNWXVKJJV-UHFFFAOYSA-N- Molecular formula
- C9H12O
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.088815
Names & identifiers
- Preferred name
- (1-Methylethoxy)benzene
- IUPAC
- propan-2-yloxybenzene
- English name
- 1-ISOPROPOXYBENZENE
- Molecular formula
- C9H12O
- Molecular weight
- 136.19
Names & synonyms
Isopropoxybenzene2741-16-4Benzene, (1-methylethoxy)-Isopropyl phenyl ether(1-Methylethoxy)benzeneIso-propoxybenzene3KY4MKN2RBDTXSID10181834RefChem:792215DTXCID50104325220-370-91-Isopropoxybenzene
Show more names
isopropylphenylether(1-methylethoxy)-benzene
propan-2-yloxybenzene(propan-2-yloxy)benzeneMFCD00048288Benzene, 1-methylethoxy-phenyl isopropyl ether2-Phenoxypropaneisopropoxy-benzeneEINECS 220-370-9
Database identifiers
- CAS
2741-16-4- PubChem CID
- 75966
- DTXSID
DTXSID10181834- UNII
- 3KY4MKN2RB
- EC Number
- 220-370-9
- Nikkaji
- J43.438H
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 82.7
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -33 °C · -33°C
- Boiling point
- 176.8 °C · 176.8°C (estimate)
- Density
- 0.9408 · 0.9408
- refractive index
- 1.4975 · 1.4975
- storage temp.
- Sealed in dry,Room Temperature
- form
- clear liquid
- color
- Colorless to Almost colorless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- HS Code
- 2902900000 · 2902900000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H227 (50%): Combustible liquid [Warning Flammable liquids]
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 4 (50%)
Safety data
- hs_code
- 2902900000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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