1-[2-methoxy-6-[(propan-2-ylamino)methyl]-4-prop-2-enylphenoxy]propane-1,3-diol

Names

[ CAS No. ]:
102612-76-0

[ Name ]:
1-[2-methoxy-6-[(propan-2-ylamino)methyl]-4-prop-2-enylphenoxy]propane-1,3-diol

[Synonym ]:
3-(4-Allyl-2-((isopropylamino)methyl)-6-methoxyphenoxy)-1,3-propanediol
1,3-Propanediol,3-(4-allyl-2-((isopropylamino)methyl)-6-methoxyphenoxy)

Chemical & Physical Properties

[ Density]:
1.084g/cm3

[ Boiling Point ]:
463.7ºC at 760mmHg

[ Molecular Formula ]:
C17H27NO4

[ Molecular Weight ]:
309.40100

[ Flash Point ]:
234.2ºC

[ Exact Mass ]:
309.19400

[ PSA ]:
70.95000

[ LogP ]:
2.39220

[ Vapour Pressure ]:
2.13E-09mmHg at 25°C

[ Index of Refraction ]:
1.53

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TY2655000
CHEMICAL NAME :
1,3-Propanediol, 3-(4-allyl-2-((isopropylamino)methyl)-6-methoxyphenox y)-
CAS REGISTRY NUMBER :
102612-76-0
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H27-N-O4
MOLECULAR WEIGHT :
309.45
WISWESSER LINE NOTATION :
Q1YQ1OR BO1 D2U1 F1MY1&1

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 :
84 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - changes in motor activity (specific assay) Vascular - shock
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 19,324,1964

Related Compounds

  • Bis-(trimethylsilyl)hyroxylamine
  • 2-[(4-Nitrophenyl)thio]-1H-imidazole
  • N-[[(4-Nitrobenzoyl)amino]thioxomethyl]glycine
  • 1-Methyl-3-(5-oxazolyl)-1H-indole
  • 4-Amino-2-(methylthio)pyrido[2,3-D]pyrimidin-5(8H)-one
  • 4-[Butyl(methyl)amino]benzoic acid
  • 5-Bromo-2-fluorobenzenesulfonic acid
  • (Z)-2-((((5-Amino-1,2,4-thiadiazol-3-yl)(carboxy)methylene)amino)oxy)-2-methylpropanoic acid
  • N-Myristoyl Histidine
  • 5-(4-methoxybenzyloxy)-4-oxo-4H-pyran-2-carboxylic acid
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