3-(2-Allyl-4-chlorophenoxy)-1,2-propanediol

Modify Date: 2025-09-28 12:15:07

3-(2-Allyl-4-chlorophenoxy)-1,2-propanediol Structure
3-(2-Allyl-4-chlorophenoxy)-1,2-propanediol structure
Common Name 3-(2-Allyl-4-chlorophenoxy)-1,2-propanediol
CAS Number 63905-19-1 Molecular Weight 242.69900
Density 1.224g/cm3 Boiling Point 391.7ºC at 760mmHg
Molecular Formula C12H15ClO3 Melting Point N/A
MSDS N/A Flash Point 190.7ºC

 Names

Name 3-(4-chloro-2-prop-2-enylphenoxy)propane-1,2-diol

 Chemical & Physical Properties

Density 1.224g/cm3
Boiling Point 391.7ºC at 760mmHg
Molecular Formula C12H15ClO3
Molecular Weight 242.69900
Flash Point 190.7ºC
Exact Mass 242.07100
PSA 49.69000
LogP 1.80050
Index of Refraction 1.559
InChIKey BPICBJMTKZLFNL-UHFFFAOYSA-N
SMILES C=CCc1cc(Cl)ccc1OCC(O)CO

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TY2400000
CHEMICAL NAME :
1,2-Propanediol, 3-(2-allyl-4-chlorophenoxy)-
CAS REGISTRY NUMBER :
63905-19-1
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-Cl-O3
MOLECULAR WEIGHT :
242.72
WISWESSER LINE NOTATION :
Q1YQ1OR DG B2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1988 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - muscle weakness Lungs, Thorax, or Respiration - other changes
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 93,470,1948
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