trimethyl isopropyl butanamide
 
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IUPAC name :N,2,3-trimethyl-2-propan-2-ylbutanamide
InChI :InChI=1/C10H21NO/c1-7(2)10(5,8(3)4)9(12)11-6/h7-8H,1-6H3,(H,11,12)
InChIKey :RWAXQWRDVUOOGG-UHFFFAOYAW
SMILES :CC(C)C(C)(C(C)C)C(=O)NC
(EINECS) number :256-974-4
cas number :51115-67-4
fema number :3804
coe number :10459
jecfa number :1595
fl. number :16.053
molar refractivity :51.88 ± 0.3 cm3
parachor :452.8 ± 4.0 cm3
index of refraction :1.431 ± 0.02
surface tension :26.1 ± 3.0 dyne/cm
density :0.854 ± 0.06 g/cm3
polarizability :20.56 ± 0.5 10-24cm3
xlogp : 2.60
molecular weight : 171.2798400
formula :C10 H21 N O
 
 
export tariff code :unspecified
fda reg :unspecified
 

Suppliers :
Fontarome Chemical :WS-23

organoleptics :
odor type :minty
odor strength :low
odor description :
at 100.00 %.  
cooling minty

properties :
appearence :white crystals
assay : 99.00 to 100.00 %   
Food Chemicals Codex Listed :No
melting point : 60.00 to 64.00 °C. @ 760.00 mm Hg
boiling point : 233.00 to 234.00 °C. @ 760.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 2.48

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 269.00  °F.  TCC  ( 131.67 °C. )
recommendation for trimethyl isopropyl butanamide usage levels up to :
 not for fragrance use.

safety links :
 
 
(EINECS) number :256-974-4
chemidplus :051115674
EPA Substance Registry Services :51115-67-4
NLM Chemical Carcinogenesis Research Information System :51115-67-4
NLM Developmental and Reproductive Toxicity :51115-67-4
NLM Env. Mutagen Info. Center :51115-67-4
NLM GENetic TOXicology :51115-67-4
EPI System :view

other :

references :
jecfa number :1595
fl. number :16.053
pubchem :207274
synonyms :
 framidice 3
 methyl diisopropyl propionamide
2-isopropyl- N,2,3-trimethylbutanamide
2-isopropyl-N,2,3-trimethyl butyramide
 trimethyl isopropyl butanamide
N,2,3-trimethyl-2-(1-methyl ethyl) butanamide
N,2,3-trimethyl-2-isopropyl butanamide
 WS-23

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
not found in nature



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Html Last modified 11/25/2008