3-(2-Chloro-6-propylphenoxy)-1,2-propanediol

Modify Date: 2025-09-23 16:41:45

3-(2-Chloro-6-propylphenoxy)-1,2-propanediol Structure
3-(2-Chloro-6-propylphenoxy)-1,2-propanediol structure
Common Name 3-(2-Chloro-6-propylphenoxy)-1,2-propanediol
CAS Number 63834-71-9 Molecular Weight 244.71500
Density 1.204g/cm3 Boiling Point 387.7ºC at 760 mmHg
Molecular Formula C12H17ClO3 Melting Point N/A
MSDS N/A Flash Point 188.3ºC

 Names

Name 3-(2-Chloro-6-propylphenoxy)-1,2-propanediol

 Chemical & Physical Properties

Density 1.204g/cm3
Boiling Point 387.7ºC at 760 mmHg
Molecular Formula C12H17ClO3
Molecular Weight 244.71500
Flash Point 188.3ºC
Exact Mass 244.08700
PSA 49.69000
LogP 2.02450
Index of Refraction 1.545
InChIKey WBEXQMNCOCWOMJ-UHFFFAOYSA-N
SMILES CCCc1cccc(Cl)c1OCC(O)CO

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TY4410000
CHEMICAL NAME :
1,2-Propanediol, 3-(2-chloro-6-propylphenoxy)-
CAS REGISTRY NUMBER :
63834-71-9
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H17-Cl-O3
MOLECULAR WEIGHT :
244.74
WISWESSER LINE NOTATION :
Q1YQ1OR BG F3

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 :
2445 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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