LINAMARIN

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Names

[ CAS No. ]:
554-35-8

[ Name ]:
LINAMARIN

[Synonym ]:
Phaseolunatin
2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropanenitrile
LINAMARIN

Chemical & Physical Properties

[ Density]:
1.41g/cm3

[ Boiling Point ]:
473.3ºC at 760mmHg

[ Melting Point ]:
142-143ºC

[ Molecular Formula ]:
C10H17NO6

[ Molecular Weight ]:
247.24500

[ Flash Point ]:
240ºC

[ Exact Mass ]:
247.10600

[ PSA ]:
123.17000

[ Index of Refraction ]:
1.549

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ4850000
CHEMICAL NAME :
Propanenitrile, 2-(beta-D-glucopyranosyloxy)-2-methyl-
CAS REGISTRY NUMBER :
554-35-8
BEILSTEIN REFERENCE NO. :
0019237
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H17-N-O6
MOLECULAR WEIGHT :
247.28
WISWESSER LINE NOTATION :
T6OTJ BQ CQ DQ EQ FOX1&1&1CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - effect, not otherwise specified Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Gastrointestinal - hypermotility, diarrhea
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 42,539,1977 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
120 mg/kg
SEX/DURATION :
female 8 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
TJADAB Teratology, The International Journal of Abnormal Development. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1968- Volume(issue)/page/year: 31,241,1985

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H315-H319-H332-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
20/22-36/37/38

[ RIDADR ]:
NONH for all modes of transport

[ RTECS ]:
TZ4850000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2,3,4,6-Tetra-O-acetyl Linamarin
  • linustatin
  • Isobutyronitrile
  • 2,3,4,6-TETRA-O-ACETYL-ALPHA-D-GLUCOPYRANOSYL TRICHLOROACETIMIDATE
  • neolinustatin

DownStream

  • β-D-Glucopyranose

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Related Compounds

  • 2,3,4,6-TETRA-O-ACETYL LINAMARIN
  • 2,3,4,6-Tetra-O-acetyl Linamarin
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • N-Cyclobutyl-5-(1-ethylpiperidin-2-yl)pyridin-2-amine
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • (3-propyl-3H-imidazo[4,5-b]pyridin-2-yl)methanamine
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine