acetyl-laevo-tryptophan
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IUPAC name :2-acetamido-3-(1H-indol-3-yl)propanoic acid
InChI :InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)
InChIKey :DZTHIGRZJZPRDV-UHFFFAOYAN
SMILES :CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O
cas number :1218-34-4
(EINECS) number :214-935-9
molar refractivity :67.12 ± 0.3 cm3
parachor :518.8 ± 4.0 cm3
index of refraction :1.945 ± 0.02
surface tension :61.6 ± 3.0 dyne/cm
density :1.330 ± 0.06 g/cm3
polarizability :26.61 ± 0.5 10-24cm3
XlogP : -1.00
XlogP3 : 1.10
molecular weight : 246.2618600
formula :C13 H14 N2 O3
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Ajinomoto :N-ACETYL-L-TRYPTOPHAN
Penta :acetyl-l-tryptophan

organoleptics :

properties :
assay : 95.00 to 100.00 %   
Food Chemicals Codex Listed :No
flash point :not determined
shelf life : 12.00 month(s) or longer if stored properly.
storage :refrigerate in tightly sealed containers.

safety :
most important hazard(s) :None - None found.
  S 02 - Keep out of the reach of children.
S 22 - Do not breath dust.
S 24/25 - Avoid contact with skin and eyes.
Oral Toxicity(LD50) :
  Intraperitoneal-Mouse    3580.00  mg/kg
Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 11, Pg. 635, 1980.

Oral-Mouse    10800.00  mg/kg
Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 11, Pg. 635, 1980.

Intraperitoneal-Rat    3900.00  mg/kg
Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 11, Pg. 635, 1980.

Oral-Rat    15000.00  mg/kg
Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 11, Pg. 635, 1980.

Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for acetyl-laevo-tryptophan usage levels up to :
 not for fragrance use.

safety references :
EPI System :view
Cancer Citations :Search
Toxicology Citations :Search
Env. Mutagen Info. Center :Search
NLM Developmental and Reproductive Toxicity :Search
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 2-acetamido-3-(1H-indol-3-yl)propanoic acid
(EINECS) number :214-935-9
RTECS :YN6160000 for 1218-34-4
chemidplus :001218344
EPA Substance Registry Services :1218-34-4
dtp/nci :90726

references :
 2-acetamido-3-(1H-indol-3-yl)propanoic acid
NIST Chemistry WebBook :1218344
pubchem :157891

other :
synonyms :
2-acetamido-3-(1H-indol-3-yl)propanoic acid
N-acetyl-laevo-tryptophan

natural occurrence in :
not found in nature



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