Basic information
- CAS
622-85-5- Standard SMILES
CCCOc1ccccc1- InChIKey
DSNYFFJTZPIKFZ-UHFFFAOYSA-N- Molecular formula
- C9H12O
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.088815
Names & identifiers
- Preferred name
- Benzene, propoxy-
- IUPAC
- propoxybenzene
- English name
- Propoxybenzene
- Molecular formula
- C9H12O
- Molecular weight
- 136.19
Names & synonyms
PropoxybenzenePHENYL PROPYL ETHERBenzene, propoxy-Ether, phenyl propylEINECS 210-756-5BRN 1634987AI3-24227DTXSID10607604-06-00-00556 (Beilstein Handbook Reference)RefChem:117341DTXCID9043275210-756-5
Show more names
propoxy-benzenpropoxy-benzenepropylphenyletherether,propylphenyl(Propyloxy)benzene
DSNYFFJTZPIKFZ-UHFFFAOYSA-NInChI=1/C9H12O/c1-2-8-10-9-6-4-3-5-7-9/h3-7H,2,8H2,1H622-85-5PropoxyphenylPropyl phenyl etherEther, propyl phenylMFCD00039935XBA82A8RYZ
Database identifiers
- CAS
622-85-5- PubChem CID
- 12155
- DTXSID
DTXSID1060760- UNII
- XBA82A8RYZ
- EC Number
- 210-756-5
- Nikkaji
- J43.437J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 74.8
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
LogP3.18
Physicochemical properties
- Melting point
- -28 °C · -28°C(lit.)
- Boiling point
- 190 °C · 190°C(lit.)
- Density
- 0.9474 · 0.9474
- refractive index
- 1.499 to · 1.4990 to 1.5030
- storage temp.
- 2 · 2-8°C
- form
- clear liquid
- color
- Colorless to Almost colorless
- λmax
- 279 nm · 279nm(EtOH)(lit.)
- CAS DataBase Reference
- 622 · 622-85-5
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 82 A8RYZ · XBA82A8RYZ
- NIST Chemistry Reference
- Propoxybenzene(622-85-5)
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Peroxide Forming Chemical
Phenyl propyl ether
D: Other compounds that may form peroxides
Kelly
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2909309090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, propoxy-: INACTIVE
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers76 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Related reactions
2 records
Compound notes
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