2,4-Pentanediol, 5-phenoxy-1,1,1-trifluoro-2-(trifluoromethyl)-

Modify Date: 2025-10-10 00:02:32

2,4-Pentanediol, 5-phenoxy-1,1,1-trifluoro-2-(trifluoromethyl)- Structure
2,4-Pentanediol, 5-phenoxy-1,1,1-trifluoro-2-(trifluoromethyl)- structure
Common Name 2,4-Pentanediol, 5-phenoxy-1,1,1-trifluoro-2-(trifluoromethyl)-
CAS Number 34848-38-9 Molecular Weight 318.21200
Density 1.419g/cm3 Boiling Point 362.1ºC at 760 mmHg
Molecular Formula C12H12F6O3 Melting Point N/A
MSDS N/A Flash Point 167ºC

 Names

Name 1,1,1-trifluoro-5-phenoxy-2-(trifluoromethyl)pentane-2,4-diol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.419g/cm3
Boiling Point 362.1ºC at 760 mmHg
Molecular Formula C12H12F6O3
Molecular Weight 318.21200
Flash Point 167ºC
Exact Mass 318.06900
PSA 49.69000
LogP 2.67210
Index of Refraction 1.447
InChIKey LLBYRSMBEDHPIS-UHFFFAOYSA-N
SMILES OC(COc1ccccc1)CC(O)(C(F)(F)F)C(F)(F)F

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SA1228000
CHEMICAL NAME :
2,4-Pentanediol, 5-phenoxy-1,1,1-trifluoro-2-(trifluoromethyl)-
CAS REGISTRY NUMBER :
34848-38-9
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H12-F6-O3
MOLECULAR WEIGHT :
318.24
WISWESSER LINE NOTATION :
FXFFXQXFFF1YQ1OR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
42 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#08986

 Synonyms

5-Phenoxy-1,1,1-trifluoro-2-trifluoromethyl-2,4-pentanediol
5-Phenoxy-1,1,1-trifluor-2-trifluormethyl-2,4-pentandiol
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