2-(2,4-Di-tert-pentylphenoxy)butryic acid

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Names

[ CAS No. ]:
13403-01-5

[ Name ]:
2-(2,4-Di-tert-pentylphenoxy)butryic acid

[Synonym ]:
MFCD00045895
2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoic acid
EINECS 236-495-7

Chemical & Physical Properties

[ Density]:
0.988 g/cm3

[ Boiling Point ]:
414.9ºC at 760 mmHg

[ Melting Point ]:
76-78ºC

[ Molecular Formula ]:
C₂₀H₃₂O₃

[ Molecular Weight ]:
320.46600

[ Flash Point ]:
134.2ºC

[ Exact Mass ]:
320.23500

[ PSA ]:
46.53000

[ LogP ]:
5.30380

[ Vapour Pressure ]:
1.25E-07mmHg at 25°C

[ Index of Refraction ]:
1.493

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: ET0600000

CHEMICAL NAME :: Butyric acid, 2-(2,4-di-tert-pentylphenoxy)-

CAS REGISTRY NUMBER :: 13403-01-5

LAST UPDATED :: 199707

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C20-H32-O3

MOLECULAR WEIGHT :: 320.52

WISWESSER LINE NOTATION :: QVY2&OR B1X1&1&1 D1X1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >3200 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 400 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: >20 mL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: KODAK* Kodak Company Reports. (343 State St., Rochester, NY 14650) Volume(issue)/page/year: 21MAY1971

Safety Information

[ HS Code ]:
2918990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

2-[2,4-bis(1,1-Dimethylpropyl) phenoxy] butyric acid ethyl ester
2-Bromobutyric acid
2,4-Di-tert-pentylphenol

DownStream

Customs

[ HS Code ]: 2918990090

[ Summary ]:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

2-[2,4-di-tert-pentylphenoxy]hexanoyl chloride
2-(2,4-Di-tert-pentylphenoxy)-N-[3-hydroxy-4-[(2,2,3,3,4,4,5,5-octafluorovaleryl)amino]phenyl]hexanamide
2-(2,4-Di-tert-pentylphenoxy)-N-[4-[3-[4-(butylsulfonyl)phenyl]ureido]-3-hydroxyphenyl]butanamide
3-Chloro-4-hydroxy-2-methyl-5-[2-(2,4-di-tert-pentylphenoxy)butyrylamino]phenoxyacetic acid methyl ester
N-(3,5-DICHLORO-2-HYDROXY-4-METHYLPHENYL)-2-(2,4-DI-TERT-PENTYLPHENOXY)-ACETAMIDE
3-(2-(2,4-di-tert-pentylphenoxy)acetamido)-N-(5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl)benzamide
2-[(Cyclopropylmethyl)amino]pyridine-4-carbonitrile
Tert-butyl 3-(hydroxymethyl)-3-(methylsulfonyloxymethyl)azetidine-1-carboxylate
2-(Furan-3-yl)ethane-1-thiol
1,3,5-Tris[(3,5-dicyclohexyl-4-hydroxyphenyl)methyl]-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
Ethyl 3,4-o-isopropylidene-1-thio-beta-d-galactopyranoside
(2R)-1-(5-methylfuran-2-yl)propan-2-amine
5-[3-(propan-2-yl)phenyl]-1H-pyrazol-3-amine
2-Mercapto-5-(trifluoromethyl)benzoic acid
1-[2-[Bis(but-3-en-2-yloxy)methyl]hexylsulfonyl]-2-[(4-methoxyphenyl)methyl]-4-nitrobenzene
N-ethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

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