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Basic Information
CAS No.: 95-13-6
Name: Indene
Molecular Structure:
Molecular Structure of 95-13-6 (Indene)
Formula: C9H8
Molecular Weight: 119.139
Synonyms: 1H-Indene;HSDB 5286;Inden;Indonaphthene;NSC 9270;
EINECS: 202-393-6
Density: 1.039 g/cm3
Melting Point: -5 - -3 °C(lit.)
Boiling Point: 181.599 °C at 760 mmHg
Flash Point: 58.889 °C
Solubility: insoluble in water
Appearance: pale yellow to orange liquid
Hazard Symbols: HarmfulXn
Risk Codes: 10-65
Safety: 23-24/25-62
Transport Information: UN 3295 3/PG 3
PSA: 0.00000
LogP: 2.25590
Synthetic route

C17H18O2

95-13-6

1-indene

Conditions
ConditionsYield
With t-butyl bromide In acetonitrile for 1h; Reflux;100%

trans-1,2-bis(hydroxydiphenylmethyl)indan

A

119-61-9

benzophenone

B

91-01-0

1,1-Diphenylmethanol

C

95-13-6

1-indene

Conditions
ConditionsYield
at 290℃; for 3h;A 99%
B 60%
C 75%
65001-59-4

2,5,7-trimethyl-indan-1-one

A

95-13-6

1-indene

B

150096-40-5

2,4,6-trimethyl-indene

Conditions
ConditionsYield
With sodium tetrahydroborate; magnesium sulfate In tetrahydrofuran; methanolA 96%
B n/a
10485-09-3

2-bromoindene

95-13-6

1-indene

Conditions
ConditionsYield
With 2-H-1,3-di-tert-butyl-1,3,2-diazaphosphorinane; 2,2'-azobis(isobutyronitrile) In toluene at 90℃; for 5h;93%
95-13-6

1-indene

Conditions
ConditionsYield
at 20℃; for 0.0833333h; chemoselective reaction;92%

6,6a-dihydro-1aH-1-thia-cyclopropa[a]indene

95-13-6

1-indene

Conditions
ConditionsYield
With molybdenum hexacarbonyl In toluene for 1.5h; Reflux; chemoselective reaction;91%
10485-09-3

2-bromoindene

[3-(dimethylamino)propyl]dimethyl aluminium(III)

A

2177-47-1

2-Methylindene

B

70063-93-3

1,2-dimethylindene

C

95-13-6

1-indene

Conditions
ConditionsYield
With tetrakis(triphenylphosphine)palladium dichloride In benzene at 80℃; for 2h; Yields of byproduct given;A 88%
B n/a
C n/a

2-(3-phenyl-2-propenyl)benzaldehyde

A

100-52-7

benzaldehyde

B

95-13-6

1-indene

Conditions
ConditionsYield
With C25H19(1+)*BF4(1-) In dichloromethane at 20℃; for 4h; Catalytic behavior; Reagent/catalyst; Solvent; Schlenk technique; Inert atmosphere;A 86%
B 71%

(E)-2-(3-(4-fluorophenyl)allyl)benzaldehyde

A

459-57-4

4-fluorobenzaldehyde

B

95-13-6

1-indene

Conditions
ConditionsYield
With C25H19(1+)*BF4(1-) In dichloromethane at 20℃; for 1.5h; Reagent/catalyst; Schlenk technique; Inert atmosphere;A 86%
B 22%
21919-44-8

1-allyl-2-vinylbenzene

95-13-6

1-indene

Conditions
ConditionsYield
With Grubbs catalyst first generation In 1,2-dichloro-ethane at 20℃; for 17h; Inert atmosphere; Sealed tube;86%
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    Product Name: Indene CAS: 95-13-6 MF: C9H8 MW: 116.16 EINECS: 202-393-6 Mol File: 95-13-6.mol Indene Structure Indene Chemical Properties Melting point -5--3 °C (lit.) Boiling point 181-182 °C (lit.) density 0.

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Consensus Reports

Reported in EPA TSCA Inventory.

Standards and Recommendations

OSHA PEL: TWA 10 ppm
ACGIH TLV: TWA 10 ppm
NIOSH REL: (Indene) TWA 10 ppm

Specification

1. Introduction of Indene

Indene ,with its CAS NO 95-13-6, is a kind of colorless or light yellow transparent liquid. It has synonyms of 1H-Indene ; HSDB 5286 ; Inden ; Indonaphthene and NSC 9270. Indene should be stored in shady and cool warehouse and mainly used in the production of indene/cumarone thermoplastic resins.

2.Properties of Indene

(1) Melting point: -5- -3 °C (2) Boiling point: 181-182 °C  (3) Density: 0.996 g/mL at 25 °C(4) Refractive index: n20/D 1.595 

(5) Flash point: 138 °F   (6) Storage temp.: 2-8°C (7) Water Solubility: INSOLUBLE
 

3.Sturcture descriptors of Indene

IUPAC Name: 1H-indene

InChI: InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2

InChIKey: YBYIRNPNPLQARY-UHFFFAOYSA-N

Canonical SMILES : C1C=CC2=CC=CC=C21
 

4.Safety information of Indene

Hazard Codes: HarmfulXn
Risk Statements: 10-65
10: Flammable
65: Harmful: May cause lung damage if swallowed
Safety Statements: 23-24/25-62
23: Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer)
24: Avoid contact with skin
25: Avoid contact with eyes
62: If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label
RIDADR: UN 3295 3/PG 3
WGK Germany: 1
RTECS: NK8225000
F: 8
HazardClass: 3
PackingGroup: III

5.Toxity data of Indene

1.    

ihl-rat LC50:14 g/m3

    GISAAA    Gigiena i Sanitariya. 41 (4)(1976),104.
2.    

unr-rat LD50:2300 mg/kg

    GISAAA    Gigiena i Sanitariya. 41 (4)(1976),104.
3.    

unr-mus LD50:1800 mg/kg

    GISAAA    Gigiena i Sanitariya. 41 (4)(1976),104.
4.    

orl-uns LD50:>5 g/kg

    GISAAA    Gigiena i Sanitariya. 39 (4)(1974),86.