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3613-80-7

3613-80-7 structure
3613-80-7 structure
  • Name: 4,5-Dithiopyridoxine
  • Chemical Name: 2-methyl-4,5-bis(sulfanylmethyl)pyridin-3-ol
  • CAS Number: 3613-80-7
  • Molecular Formula: C8H11NOS2
  • Molecular Weight: 201.30900
  • Create Date: 2016-12-12 22:51:09
  • Modify Date: 2024-02-01 18:45:27

Name 2-methyl-4,5-bis(sulfanylmethyl)pyridin-3-ol
Synonyms 5-Hydroxy-6-methyl-3,4-pyridinedimethanethiol
4',5'-Dithiopyridoxin
4,5-bis-mercaptomethyl-2-methyl-pyridin-3-ol
4',5'-Dithiopyridoxine
Density 1.273g/cm3
Boiling Point 453.8ºC at 760 mmHg
Molecular Formula C8H11NOS2
Molecular Weight 201.30900
Flash Point 228.2ºC
Exact Mass 201.02800
PSA 110.72000
LogP 1.95520
Index of Refraction 1.636

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UU7703000
CHEMICAL NAME :
3-Pyridinol, 4,5-bis(mercaptomethyl)-2-methyl-
CAS REGISTRY NUMBER :
3613-80-7
BEILSTEIN REFERENCE NO. :
0140813
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H11-N-O-S2
MOLECULAR WEIGHT :
201.32
WISWESSER LINE NOTATION :
T6NJ B1 CQ D1SH E1SH

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 :
74 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. (Berlin, Ger.) V.110-253, 1925-66. For publisher information, see NSAPCC. Volume(issue)/page/year: 238,116,1960
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%