3-Pyridinemethanol, 6-chloro-alpha-(4-fluorophenyl)-

Modify Date: 2024-04-02 17:59:05

3-Pyridinemethanol, 6-chloro-alpha-(4-fluorophenyl)- Structure
3-Pyridinemethanol, 6-chloro-alpha-(4-fluorophenyl)- structure
Common Name 3-Pyridinemethanol, 6-chloro-alpha-(4-fluorophenyl)-
CAS Number 80100-31-8 Molecular Weight 237.65700
Density 1.346g/cm3 Boiling Point 390.8ºC at 760 mmHg
Molecular Formula C12H9ClFNO Melting Point N/A
MSDS N/A Flash Point 190.1ºC

 Names

Name (6-chloropyridin-3-yl)-(4-fluorophenyl)methanol

 Chemical & Physical Properties

Density 1.346g/cm3
Boiling Point 390.8ºC at 760 mmHg
Molecular Formula C12H9ClFNO
Molecular Weight 237.65700
Flash Point 190.1ºC
Exact Mass 237.03600
PSA 33.12000
LogP 2.95580
Index of Refraction 1.596
InChIKey WFNZDDQFMVDKTF-UHFFFAOYSA-N
SMILES OC(c1ccc(F)cc1)c1ccc(Cl)nc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UT4751500
CHEMICAL NAME :
3-Pyridinemethanol, 6-chloro-alpha-(4-fluorophenyl)-
CAS REGISTRY NUMBER :
80100-31-8
LAST UPDATED :
199606
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H9-Cl-F-N-O
MOLECULAR WEIGHT :
237.67

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4736037
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