propan-2-yl 2-hydroxy-2-phenylacetate

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Names

[ CAS No. ]:
4118-51-8

[ Name ]:
propan-2-yl 2-hydroxy-2-phenylacetate

[Synonym ]:
Isopropyl hydroxy(phenyl)acetate
isopropyl 2-hydroxy-2-phenylacetate
Benzeneacetic acid, α-hydroxy-, 1-methylethyl ester (9CI)
MANDELIC ACID,ISOPROPYL ESTER
Benzeneacetic acid, α-hydroxy-, 1-methylethyl ester
VOY1&i-propyl mandelate
Isopropyl mandelate

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
291.8±20.0 °C at 760 mmHg

[ Molecular Formula ]:
C11H14O3

[ Molecular Weight ]:
194.227

[ Flash Point ]:
119.4±14.5 °C

[ Exact Mass ]:
194.094299

[ PSA ]:
46.53000

[ LogP ]:
1.78

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.521

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OO7600000
CHEMICAL NAME :
Mandelic acid, isopropyl ester
CAS REGISTRY NUMBER :
4118-51-8
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-O3
MOLECULAR WEIGHT :
194.25
WISWESSER LINE NOTATION :
QYR&VOY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AJOPAA American Journal of Ophthalmology. (Ophthalmic Pub. Co., 435 N. Michigan Ave., Suite 1415, Chicago, IL 60611) Series 3: V.1- 1918- Volume(issue)/page/year: 29,1363,1946

Safety Information

[ Hazard Codes ]:
Xi

[ HS Code ]:
2918199090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • ISOPROPYLPHENYLGLYOXYLATE
  • Mandelic acid
  • Isopropanol
  • Phenylglyoxal
  • 2-Hydroxy-2-phenyl-1,1,1-tris-(phenylmercapto)-aethan
  • Ethyl oxophenylacetate
  • Phenylglyoxylic acid
  • Benzeneacetyl chloride, alpha-oxo- (9CI)

DownStream

  • ISOPROPYLPHENYLGLYOXYLATE

Customs

[ HS Code ]: 2918199090

[ Summary ]:
2918199090 other carboxylic acids with alcohol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

Related Compounds

  • propan-2-yl 2-hydroxy-2-methylpropanimidate
  • 1-(diethylamino)propan-2-yl 2-hydroxy-2,2-diphenylacetate
  • Propanoic acid, 2-hydroxy-2-Methyl-, 1-Methylethyl ester
  • Benzeneacetic acid, a-hydroxy-, 4-ethyl-1-methyloctylester
  • Hydroxydiphenylacetic acid=2-(9-azabicyclo[3.3.1]nonan-9-yl)-1-methylethyl ester
  • propan-2-yl 2-diazo-2-phenylacetate
  • 5-{[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylpentanamido]methyl}-1,3-oxazole-4-carboxylic acid
  • 2-{3-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2,2-dimethylpropanamido]cyclobutyl}acetic acid
  • 1-(Thiomorpholin-2-yl)but-3-yn-1-one
  • 2-(1-Ethoxyethyl)-2-methyloxirane
  • 1-[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]methanamine hydrochloride
  • O-[(5-bromopyrimidin-2-yl)methyl]hydroxylamine
  • 5-{2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-1,3-thiazol-4-yl]acetamido}pentanoic acid
  • (2R)-2-({2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)ethyl]phenyl}formamido)propanoic acid
  • eeAChE/eqBuChE-IN-1
  • 2-methyl-3-(2H-1,2,3-triazol-2-yl)aniline
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