2-methyl-2-[(2-methyl-1,3-dithiolan-2-yl)methyl]-1,3-dithiolane

Names

[ CAS No. ]:
19451-23-1

[ Name ]:
2-methyl-2-[(2-methyl-1,3-dithiolan-2-yl)methyl]-1,3-dithiolane

Chemical & Physical Properties

[ Density]:
1.226g/cm3

[ Boiling Point ]:
363.6ºC at 760 mmHg

[ Molecular Formula ]:
C9H16S4

[ Molecular Weight ]:
252.48300

[ Flash Point ]:
228.7ºC

[ Exact Mass ]:
252.01300

[ PSA ]:
101.20000

[ LogP ]:
3.76890

[ Vapour Pressure ]:
3.74E-05mmHg at 25°C

[ Index of Refraction ]:
1.619

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
JP1169000
CHEMICAL NAME :
1,3-Dithiolane, 2,2'-methylenebis(2-methyl-
CAS REGISTRY NUMBER :
19451-23-1
BEILSTEIN REFERENCE NO. :
4375867
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H16-S4
MOLECULAR WEIGHT :
252.49
WISWESSER LINE NOTATION :
T5S CSTJ B1 B1- BT5S CSTJ B1

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 :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 17,235,1982

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1,2-Ethanedithiol
  • 2,4-Pentandione
  • 1-(2-methyl-1,3-dithiolan-2-yl)propan-2-one

DownStream

  • 1-(2-methyl-1,3-dithiolan-2-yl)propan-2-one
  • 2,4-Pentandione

Related Compounds

  • Ethyl 4-phenyl-2-[(phenylsulfonyl)amino]-5-thiazolecarboxylate
  • 3-Ethoxy-5-isopropylbenzoic acid
  • Tert-butyl 3'-(1-aminoethyl)-[1,1'-biphenyl]-4-carboxylate
  • 2-[1-(2-Fluoropropan-2-yl)cyclopropyl]ethan-1-amine
  • rac-(3R,4R)-1-[2-ethyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoyl]-4-methylpyrrolidine-3-carboxylic acid
  • 4-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-N-methylhexanamido]oxolane-3-carboxylic acid
  • 4-[6-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-N-methylhexanamido]oxolane-3-carboxylic acid
  • 2-{4-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylpentanoyl]thiomorpholin-3-yl}acetic acid
  • 2-(4-{2-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]pentanoyl}thiomorpholin-3-yl)acetic acid
  • 3-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanoyl]-2-propyl-1,3-thiazolidine-4-carboxylic acid
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