chamomile valerate 6297-41-2

chamomile valerate

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Notes :

Blends well with mint oils.

Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).

IUPAC name :

butyl 2-methylpentanoate

InChI :

InChI=1/C10H20O2/c1-4-6-8-12-10(11)9(3)7-5-2/h9H,4-8H2,1-3H3

InChIKey :

FMVUGLMJUHFPSJ-UHFFFAOYAZ

SMILES :

CCCCOC(=O)C(C)CCC

cas number :	6297-41-2
(EINECS) number :	228-569-2
fl. number :	09.322
molar refractivity :	50.11 ± 0.3 cm3
parachor :	452.1 ± 4.0 cm3
index of refraction :	1.421 ± 0.02
surface tension :	27.4 ± 3.0 dyne/cm
density :	0.872 ± 0.06 g/cm3
polarizability :	19.86 ± 0.5 10-24cm3
XlogP :	3.30
molecular weight :	172.2646000
formula :	C10 H20 O2

export tariff code :

2915.60.0000

fda reg :

unspecified

Suppliers :

Grau Aromatics :

BUTYL-2-METHYLVALERATE

Inoue :

BUTYL 2-METHYL VALERATE

organoleptics :

odor type :

herbal

odor strength :

medium ,
recommend smelling in a 10.00 % solution or less

odor description :
at 10.00 % in dipropylene glycol.

aromatic floral fruity chamomile rose

substantivity :

4 Hour(s)

properties :

appearence :

colorless clear liquid

assay :

98.00 to 100.00 %

Food Chemicals Codex Listed :

flash point :

171.00 °F. TCC ( 77.22 °C. )

logP (o/w) :

3.71

safety :

Oral Toxicity(LD50) :

Oral-Mouse 8000.00 mg/kg

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

recommendation for chamomile valerate usage levels up to :

1.0000 % in the fragrance concentrate.

safety references :

EPI System :

view

Canada Domestic Sub. List :

Yes

EPA Chem. Sub. Inventory :

Yes

WGK Germany :

butyl 2-methylpentanoate

(EINECS) number :

228-569-2

chemidplus :

006297412

EPA Substance Registry Services :

6297-41-2

dtp/nci :

17885

references :

butyl 2-methylpentanoate

fl. number :

09.322

NIST Chemistry WebBook :

324799479

pubchem :

672697

Cosmetics :

Cosmetic uses :

perfuming agents

other :

CosIng :

cosmetic data

synonyms :
	butyl 2-methyl pentanoate
	butyl 2-methyl valerate
	butyl 2-methylpentanoate
	butyl alpha-methyl valerate
	butyl isohexanoate
	methyl camomille
soluble in :
	alcohol
	water, 55 mg/L @ 20C
insoluble in :
	water
(odor and/or flavor) blends with :
	acetal 318
1-	acetyl cyclohexyl acetate
iso	amyl 3-(2-furan) propionate
	amyl angelate
iso	amyl angelate
alpha-	amyl cinnamaldehyde
	amyl furoate
iso	amyl heptanoate
iso	amyl salicylate
iso	amyl undecylenate
para-	anisyl formate
	benzaldehyde / methyl anthranilate schiff's base
	benzyl acetate
	benzyl acetoacetate
	benzyl alcohol
	benzyl cinnamate
	benzyl formate
	berry hexanoate
beta-	bisabolol
iso	butyl anthranilate
iso	butyl benzyl carbinol
	butyl benzyl ether
iso	butyl furyl propionate
	butyl levulinate
2-	butyl thiophene
	butyl tiglate
	butyl undecylenate
	cajuput oil
	carrot seed oil spain
	chamomile isobutyrate
	chamomile octenone
	chamomile oil
	chamomile propionate
	cinnamyl formate
	citronellyl butyrate
	citronellyl hexanoate
	citronellyl isobutyrate
	citronellyl isovalerate
	citronellyl propionate
(E)-	citronellyl tiglate
	clary propyl acetate
	cuminyl acetate
(E)-alpha-	damascone
(E)-beta-	damascone
(Z)-alpha-	damascone
(Z)-beta-	damascone
beta-	damascone
gamma-	damascone
2-	decalinyl acetate
iso	decanal
(Z)-4-	decen-1-yl acetate
	diethyl malate
2,4-	difurfuryl furan
	dihydrocarvyl acetate
	dihydrojasmone
	dimethyl benzyl carbinyl acetate
2,4-	dimethyl-3-cyclohexene-1-methanol
S-(2,5-	dimethyl-3-furyl) ethane thioate
(E+Z)-4,8-	dimethyl-3,7-nonadien-2-one
2,10-	epoxypinane
	ethyl 2-furoate
	ethyl levulinate
	ethyl linalool
	ethyl linalyl acetal
	eucalyptus oil
	farnesyl acetate
	floral pyran
	geranic oxide
	geraniol
	geranyl acetate
(E)-	geranyl linalool
	geranyl octanoate
	geranyl tiglate
	gingergrass oil
	globulol
	hawthorn ethanol
2-	heptanol
	heptyl butyrate
	heptyl formate
	heptyl isobutyrate
	herbal acetal
	herbal pyran
(Z)-3-	hexen-1-yl isovalerate
	hexoxyacetaldehyde dimethyl acetal
2-	hexyl-4-acetoxytetrahydrofuran
	hyssop oil
	karo karounde absolute
	lavandin oil
	lavender absolute
	lavender oil france
	lavender oil greece
	linalyl octanoate
	lovage root absolute
	lovage root oil
para-	menth-1-ene-9-ol
	menthadienyl formate
1-para-	menthen-9-yl acetate
	menthone-8-thioacetate
3-	mercaptohexyl acetate
	methoxymelonal
	methyl (Z)-3-hexenoate
	methyl 4-phenyl butyrate
	methyl alpha-ionone
	methyl benzyl acetate (mixed ortho-,meta-,para-)
	methyl cyclogeranate
	methyl decanoate
alpha-iso	methyl ionone (90% min.)
	methyl ionyl acetate
	methyl isobutyrate
2-	methyl octanal
(E)-7-	methyl-3-octen-2-one
	musk acetate
	myrtle oil
	neryl acetate
	neryl isovalerate
	nonanal diethyl acetal
	nonanol
3-	nonanon-1-yl acetate
(Z)-beta-	ocimene
3-	octanon-1-ol
	orris capronate
	phenethyl acetate
	phenethyl anthranilate
	phenethyl isobutyrate
	phenethyl isovalerate
	phenethyl phenyl acetate
	phenethyl salicylate
	phenyl acetaldehyde
	phenyl acetaldehyde digeranyl acetal
1-	phenyl propyl butyrate
2-	phenyl propyl isobutyrate
4-	phenyl-3-buten-2-ol
2-	phenyl-4-pentenal
iso	phytol
	prenyl salicylate
iso	propyl benzoate
	rhubarb pyran
laevo-	rose oxide
	rose undecene
	strawberry glycidate 2
	styralyl propionate
	terpinyl isobutyrate
	terpinyl valerate
	tetrahydroionyl acetate
4-(para-	tolyl)-2-butanone
	tricyclodecenyl propionate
	tropical ionone
(E)-2-	undecen-1-ol
2-	undecen-1-ol
	verymoss
(odor and/or flavor) used in :
	chamomile
	floral
	fruit
	herbal
	moss
	rose
natural occurrence in :
	not found in nature

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