Shanghai Nianxing Industrial Co., Ltd
China
Product Name: Palmitic acid
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Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 4-(2-Chloroethylthio)nicotinic acid
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Purity: 98.0%
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13096-15-6

13096-15-6 structure

13096-15-6 structure

Name: 4-(2-Chloroethylthio)nicotinic acid
Chemical Name: 4-(2-chloroethylsulfanyl)pyridine-3-carboxylic acid
CAS Number: 13096-15-6
Molecular Formula: C₈H₈ClNO₂S
Molecular Weight: 217.67300
Create Date: 2016-11-14 23:39:42
Modify Date: 2024-09-26 23:15:54

Name	4-(2-chloroethylsulfanyl)pyridine-3-carboxylic acid
Synonyms	4-(2-Chloroethylthio)nicotinic acid Nicotinic acid,4-(2-chloroethylthio) 4-(2-chloro-ethylsulfanyl)-nicotinic acid 4-(2-Chloroethylthio)-3-pyridinecarboxylic acid 3-Pyridinecarboxylic acid,4-(2-chloroethylthio)

Density	1.43g/cm3
Boiling Point	377.2ºC at 760 mmHg
Molecular Formula	C₈H₈ClNO₂S
Molecular Weight	217.67300
Flash Point	182ºC
Exact Mass	216.99600
PSA	75.49000
LogP	2.11070
Vapour Pressure	2.31E-06mmHg at 25°C
Index of Refraction	1.612

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QT0885000

CHEMICAL NAME :: Nicotinic acid, 4-(2-chloroethylthio)-

CAS REGISTRY NUMBER :: 13096-15-6

BEILSTEIN REFERENCE NO. :: 0392562

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C8-H8-Cl-N-O2-S

MOLECULAR WEIGHT :: 217.68

WISWESSER LINE NOTATION :: T6NJ CVQ DS2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 50 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 10,257,1967

HS Code	2933399090

HS Code	2933399090
Summary	2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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