2-Indanone

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Names

[ CAS No. ]:
615-13-4

[ Name ]:
2-Indanone

[Synonym ]:
EINECS 210-410-3
MFCD00003792
1,3-dihydroinden-2-one
2-Indanone
2-oxo-2,3-dihydro-1H-indene
2H-Inden-2-one, 1,3-dihydro-
2H-Inden-2-one,1,3-dihydro
2,3-dihydro-1H-inden-2-one
1,3-Dihydro-2H-inden-2-one
indan-2-one

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
248.9±29.0 °C at 760 mmHg

[ Melting Point ]:
51-54 °C(lit.)

[ Molecular Formula ]:
C₉H₈O

[ Molecular Weight ]:
132.159

[ Flash Point ]:
100.0±0.0 °C

[ Exact Mass ]:
132.057510

[ PSA ]:
17.07000

[ LogP ]:
1.23

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.585

[ Storage condition ]:
2-8°C

[ Water Solubility ]:
insoluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NK7535500

CHEMICAL NAME :: 2-Indanone

CAS REGISTRY NUMBER :: 615-13-4

BEILSTEIN REFERENCE NO. :: 0636550

LAST UPDATED :: 199709

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C9-H8-O

MOLECULAR WEIGHT :: 132.17

WISWESSER LINE NOTATION :: L56 CVT&J

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 mg/kg

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#08390

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 ]:
S22-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
NK7535500

[ Packaging Group ]:
II; III

[ Hazard Class ]:
4.1

[ HS Code ]:
2914399090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Indene
2-Indanol
6,6A-DIHYDRO-1AH-INDENO[1,2-B]OXIRENE
TRANS-2-BROMO-2,3-DIHYDRO-1H-INDEN-1-OL
2-Indanone oxime
carbon monoxide
o-Xylylene dichloride
α,α′-dibromo-o-xylene
1,2-Dihydroxyindan
phenylpropyne

DownStream

2-Indanone oxime
Ninhydrin
Ethanone, 1-(2,3-dihydro-1H-inden-2-yl)- (9CI)
2-Aminoindan-2-phosphonic acid
2-(2,3-dihydro-1H-inden-2-yl)acetamide
methyl-bis(2-methyl-1H-inden-1-yl)-phenylsilane
4-(1H-inden-2-yl)phenol
1H-INDENE-2-ACETIC ACID,2,3-DIHYDRO-,ETHYL ESTER
2-Phenylindene
2-Indanol

Customs

[ HS Code ]: 2914399090

[ Summary ]:
2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Articles

Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.

J. Med. Chem. 48 , 3808-15, (2005)

The purpose of this study was to determine the cytochrome P450 1A2 (CYP1A2) inhibition potencies of structurally diverse compounds to create a comprehensive three-dimensional quantitative structure-ac...

Synthesis of indenoporphyrins, highly modified porphyrins with reduced diatropic characteristics.

J. Org. Chem. 76(13) , 5335-45, (2011)

Indene-fused porphyrins have been synthesized starting from 2-indanone. Knorr-type reaction of oximes derived from benzyl or tert-butyl acetoacetate with 2-indanone and zinc dust in propionic acid gav...

Bromoform activation. TiCl4-Mg-promoted CHBr2- and CBr3- transfer to a variety of aldehydes and ketones.

Org. Lett. 15(22) , 5802-5, (2013)

TiCl4-Mg can mediate addition of CHBr3 to a variety of aldehydes and ketones to form dibromomethyl carbinols and also be used to effect CBr3 transfer to carbonyl groups to form tribromomethyl carbinol...