7-Methyl-1-Indanone supplier | CasNO.39627-61-7

Name
7-Methyl-1-Indanone
EINECS
CAS No. 39627-61-7
Article Data33
CAS DataBase
Density 1.113
Solubility
Melting Point 52-56 °C
Formula C₁₀H₁₀O
Boiling Point 260.4 ºCat 760 mmHg
Molecular Weight 146.189
Flash Point 107.2 ºC
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 7-Methyl-indan-1-one;1-Indanone-7-carboxylic acid;7-methyl-2,3-dihydro-1H-inden-1-one;7-methlyindanone
PSA 17.07000
LogP 2.12390

7-Methyl-1-Indanone Specification

The 7-Methyl-1-Indanone, with the 39627-61-7, has the systematic name of 7-methyl-2,3-dihydro-1H-inden-1-one.

The physical properties of this chemical are as follows: (1)ACD/LogP: 2.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.56; (4)ACD/LogD (pH 7.4): 2.56; (5)ACD/BCF (pH 5.5): 51.88; (6)ACD/BCF (pH 7.4): 51.88; (7)ACD/KOC (pH 5.5): 587.78; (8)ACD/KOC (pH 7.4): 587.78; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.07 ; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 43.38 cm³; (15)Molar Volume: 131.2 cm³; (16)Polarizability: 17.19 ×10^-24 cm³; (17)Surface Tension: 42.8 dyne/cm; (18)Density: 1.113 g/cm³; (19)Flash Point: 107.2 °C; (20)Enthalpy of Vaporization: 49.81 kJ/mol; (21)Boiling Point: 260.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0123 mmHg at 25°C.

In addition, you could convert the following datas into the molecular structure:
(1)SMILES:O=C2c1c(cccc1CC2)C
(2)InChI:InChI=1/C10H10O/c1-7-3-2-4-8-5-6-9(11)10(7)8/h2-4H,5-6H2,1H3
(3)InChIKey:OXALDISRDZGNV-UHFFFAOYAW

Product Name

7-Methyl-1-Indanone

7-Methyl-1-Indanone Specification

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