3-Oxo-1-indanecarboxylic acid

Names

[ Name ]:
3-Oxo-1-indanecarboxylic acid

[Synonym ]:
3-Oxo-1-indanecarboxylic acid
MFCD00092224
1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-
1-carboxy-3-indanone
3-Oxo-2,3-dihydro-1H-indene-1-carboxylic acid
3-oxo-1-indancarboxylicacid
3-Oxo-1-indancarboxylic acid
3-Oxo-indan-1-carboxylic acid
3-Oxoindane-1-carboxylic acid

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
365.0±41.0 °C at 760 mmHg

[ Melting Point ]:
111-113 °C(lit.)

[ Molecular Formula ]:
C₁₀H₈O₃

[ Molecular Weight ]:
176.169

[ Flash Point ]:
188.7±24.1 °C

[ Exact Mass ]:
176.047348

[ PSA ]:
54.37000

[ LogP ]:
0.98

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.619

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NK8260000

CHEMICAL NAME :: 1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-

CAS REGISTRY NUMBER :: 29427-69-8

BEILSTEIN REFERENCE NO. :: 2098797

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C10-H8-O3

MOLECULAR WEIGHT :: 176.18

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 :: 1650 mg/kg

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

REFERENCE :: IJPPAZ Indian Journal of Physiology and Pharmacology. (All India Institute of Medical Sciences, Dept. of Physiology, Ansari Nagar, New Delhi 110 029, India) V.1- 1957- Volume(issue)/page/year: 24,310,1980

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
NK8260000

[ HS Code ]:
2918300090

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2918300090

[ Summary ]:
2918300090 other carboxylic acids with aldehyde or ketone 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%

Articles

Kinetic resolution of 3-hydroxymethylbenzocycloalkanols by selective asymmetric hydrogen-transfer oxidation. Caro Y, et al.

Tetrahedron Asymmetry 14(23) , 3689-96, (2003)

Super/subcritical fluid chromatography separations with four synthetic polymeric chiral stationary phases. Han X, et al.

Chromatographia 65(7-8) , 381-400, (2007)

Extending the Range of Solvents for Chiral Analysis Using a New Immobilized Polysaccharide Chiral Stationary Phase, CHIRALPAK IA. Cox GB and Amoss CW.

LCGC North Am. 22(2) , 32, (2004)