2-Isopropyl-2-phenylacetic acid

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Names

[ CAS No. ]:
3508-94-9

[ Name ]:
2-Isopropyl-2-phenylacetic acid

[Synonym ]:
(+)-3-METHYL-2-PHENYLBUTYRIC ACID
1-Isopropyl-1-phenyl acetic acid
2-ISOPROPYL-2-PHENYLACETIC ACID
Alpha-Isopropylphenylacetic Acid
2-Phenylisovaleric acid
MFCD00021708
isopropylphenylacetic acid
3-methyl-2-phenyl-butyricaci
RARECHEM AL BO 0360
2-phenyl-3-methylbutyric acid
3-Methyl-2-phenylbutyric acid
2-Phenyl-3-methylbutanoic acid
3-methyl-2-phenyl-butyricacid

Chemical & Physical Properties

[ Density]:
1.063g/cm3

[ Boiling Point ]:
282ºC at 760mmHg

[ Melting Point ]:
59-61°C

[ Molecular Formula ]:
C11H14O2

[ Molecular Weight ]:
178.22800

[ Flash Point ]:
179.2ºC

[ Exact Mass ]:
178.09900

[ PSA ]:
37.30000

[ LogP ]:
2.51080

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ET5750060
CHEMICAL NAME :
Butyric acid, 3-methyl-2-phenyl-
CAS REGISTRY NUMBER :
3508-94-9
BEILSTEIN REFERENCE NO. :
2045915
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-O2
MOLECULAR WEIGHT :
178.25
WISWESSER LINE NOTATION :
QVYR&Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1193 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 16,23,1961

Safety Information

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RTECS ]:
ET5750060

[ HS Code ]:
2916399090

Precursor & DownStream

Precursor

  • 2-Iodopropane
  • Phenylacetic acid
  • 2-PHENYL-3-METHYLBUTANOICACID,METHYLESTER
  • 2-Bromopropane
  • 2-Isopropyl-2-phenylacetonitrile
  • (E)-(2-NITROVINYL)BENZENE
  • Bromo(isopropyl)magnesium
  • Diethyl phenylmalonate
  • Benzyl cyanide
  • 3-methyl-2-phenyl-but-1-en-1-one

DownStream

  • (R)-3-Methyl-2-phenylbutanoic acid
  • (AS)-A-ISOPROPYLBENZENEACETIC ACID
  • β-Isopropyl-N,N-dimethylbenzeneethanamine
  • (2-Methyl-1-methylenepropyl)benzene
  • UNII:OC2500269O

Customs

[ HS Code ]: 2916399090

[ Summary ]:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 2-isopropyl-2-propylmalonic acid
  • 2-isopropyl-2-methylmalonic acid
  • 2-(2-naphthalenyl)phenylacetic acid
  • 2-(diethylamino)-2-phenylacetic acid
  • 2-Bromo-2-phenylacetic acid
  • 2-(nitrooxy)-2-phenylacetic acid
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • (2S,3S)-3-Phenyltetrahydrofuran-2-carboxylic acid
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • 2-Methyl-2-(5-methylthiophen-2-yl)propan-1-ol
  • tert-Butyl-DL-alanine