Hydroxyacetone benzoate

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Names

[ Name ]:
Hydroxyacetone benzoate

[Synonym ]:
BENZOIC ACID,ACETYLMETHYL ESTER
benzoic acid 2-oxo-propyl ester
1,2-Propanediol,1-benzoate
benzoyloxy-acetone
O-benzoyl-hydroxyacetone
1-Benzoyloxypropan-2-one
2-Propanone,1-(benzoyloxy)

Chemical & Physical Properties

[ Density]:
1.131g/cm3

[ Boiling Point ]:
300ºC at 760 mmHg

[ Molecular Formula ]:
C₁₀H₁₀O₃

[ Molecular Weight ]:
178.18500

[ Exact Mass ]:
178.06300

[ PSA ]:
43.37000

[ LogP ]:
1.43240

[ Index of Refraction ]:
1.512

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DG0925000

CHEMICAL NAME :: Benzoic acid, acetylmethyl ester

CAS REGISTRY NUMBER :: 6656-60-6

BEILSTEIN REFERENCE NO. :: 1949247

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C10-H10-O3

MOLECULAR WEIGHT :: 178.20

WISWESSER LINE NOTATION :: 1V1OVR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1400 mg/kg

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

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,644,1977

Safety Information

[ HS Code ]:
2916310090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Benzoyl chloride
acetol
Benzoic acid,2-propen-1-yl ester
Propargyl alcohol
benzoic acid
Benzaldehyde propylene glycol acetal
2-Propyn-1-ol,1-benzoate
Sodium Benzoate
Chloroacetone
(4-Iodo-1H-pyrazol-1-yl)(phenyl)methanone

DownStream

Customs

[ HS Code ]: 2916310090

[ Summary ]:
2916310090 other benzoic acid and its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%