ammonium isovalerate 30% in pg 7563-33-9

ammonium isovalerate 30% in pg

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IUPAC name :

azane; 3-methylbutanoic acid

InChI :

InChI=1/C5H10O2.H3N/c1-4(2)3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);1H3

InChIKey :

RKCHCKMAQPJXBM-UHFFFAOYAV

SMILES :

CC(C)CC(=O)O.N

cas number :	7563-33-9
% from :	30.00%
(EINECS) number :	231-458-1
fema number :	2054
coe number :	464
jecfa number :	1203
fl. number :	16.001
molar refractivity :	30.27 ± 0.3 cm3
parachor :	279.2 ± 4.0 cm3
index of refraction :	1.463 ± 0.02
surface tension :	41.9 ± 3.0 dyne/cm
density :	1.067 ± 0.06 g/cm3
polarizability :	12.00 ± 0.5 10-24cm3
molecular weight :	119.1622200 (IUPAC)
formula :	C5 H13 N O2
NMR Predictor :	Predict

IUPAC name :

propane-1,2-diol

InChI :

InChI=1/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3

InChIKey :

DNIAPMSPPWPWGF-UHFFFAOYAE

SMILES :

CC(CO)O

cas number :	57-55-6
% from :	70.00%
(EINECS) number :	200-338-0
beilstein number :	1340498
fema number :	2940
coe number :	2065
jecfa number :	925
molar refractivity :	18.97 ± 0.3 cm3
parachor :	182.3 ± 4.0 cm3
index of refraction :	1.430 ± 0.02
surface tension :	38.0 ± 3.0 dyne/cm
density :	1.036 ± 0.06 g/cm3
polarizability :	7.52 ± 0.5 10-24cm3
XlogP :	-0.70
molecular weight :	76.0944200 (IUPAC)
formula :	C3 H8 O2
BioActivity Analysis :	113462
NMR Predictor :	Predict

export tariff code :

2915.60.0000

fda reg :

172.515

Suppliers :

Frutarom :

AMMONIUM ISOVALERATE
30% IN PG, NI, Kosher
Odor: Cheese, Fruity, Rancid

Penta :

ammonium isovalerate

organoleptics :

odor strength :

high ,
recommend smelling in a 0.10 % solution or less

odor description :
at 100.00 %.

valeric acid fruity sharp cheesy

properties :

appearence :

colorless clear liquid

assay :

30.00 to 100.00 %

Food Chemicals Codex Listed :

specific gravity :

1.01014 to 1.02500 @ 20.00 °C.

pounds per gallon - calc. :

8.415 to 8.539

refractive index :

1.42500 to 1.43600 @ 20.00 °C.

flash point :

> 212.00 °F. TCC ( > 100.00 °C. )

logP (o/w) :

1.13

safety :

most important hazard(s) :

Xn - Harmful.

R 22 - Harmful if swallowed.
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

recommendation for ammonium isovalerate 30% in pg usage levels up to :

not for fragrance use.

recommendation for ammonium isovalerate 30% in pg usage levels up to :

50.0000 ppm in the flavor.

safety references :

EPI System :

view

Canada Domestic Sub. List :

Yes

azane; 3-methylbutanoic acid

(EINECS) number :

231-458-1

chemidplus :

007563339

EPA Substance Registry Services :

7563-33-9

propane-1,2-diol

(EINECS) number :

200-338-0

RTECS :

TY2000000 for 57-55-6

chemidplus :

000057556

EPA Substance Registry Services :

57-55-6

dtp/nci :

69860

references :

azane; 3-methylbutanoic acid

fl. number :

16.001

jecfa number :

1203

pubchem :

197677

propane-1,2-diol

jecfa number :

925

NIST Chemistry WebBook :

3065598978

pubchem :

148831

other :

VCF-Online:

VCF Volatile Compounds in Food

FDA Everything Added to Food in the United States (EAFUS)

View

synonyms :
	ammonium 3-methyl butanoate 30% in pg
	ammonium isovalerianate 30% in pg
	azane; 3-methylbutanoic acid
3-	methyl butanoic acid ammonium salt 30% in pg
iso	valeric acid ammonium salt 30% in pg
soluble in :
	alcohol
	water
(odor and/or flavor) blends with :
	acetoin butyrate
	acetyl propionyl
iso	butyl amine
	butyl butyryl lactate
	butyric acid
iso	butyric acid
	cyclohexyl acetic acid
	cyclohexyl carboxylic acid
1,3-	dimethoxybenzene
	dimethyl sulfoxide
2,4-	dimethyl-2-pentenoic acid
2-	ethyl butyric acid
	ethyl cyclohexyl carboxylate
	filbert hexenone
(E,E)-2,4-	heptadien-1-ol
2,3-	heptane dione
4-	heptanone
	hexanoic acid
(E)-2-	hexen-1-al
(Z)-3-	hexenoic acid
2-	methyl 3-(methyl thio) furan 10% in triacetin
	methyl 4-(methyl thio) butyrate
	methyl 4-methyl valerate
2-	methyl butyl isovalerate
2-	methyl butyric acid
2-	methyl heptanoic acid
2-	methyl hexanoic acid
5-	methyl hexanoic acid
4-	methyl pentanoic acid
S-(	methyl thio) butyrate
	methyl thiol isovalerate
2-	methyl valeric acid
3-	methyl valeric acid
2-	methyl-2-hexenoic acid
2-	methyl-4-pentenoic acid
	nonanoic acid
2-	nonanol
	nutty quinoxaline
(E)-2-	octenoic acid
(E)-2-	pentenoic acid
4-	pentenoic acid
	prenyl hexanoate
iso	propenyl acetate
	sorbyl butyrate
	tagete oil egypt
	tagete oil rwanda
	undecanoic acid
(odor and/or flavor) used in :
	butter
	cheese
	cheese swiss cheese
	nut
natural occurrence in :
	found in nature

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