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38072-94-5

Basic Information
CAS No.: 38072-94-5
Name: 1-METHYLNAPHTHALENE-D10
Article Data: 2
Molecular Structure:
Molecular Structure of 38072-94-5 (1-METHYLNAPHTHALENE-D10)
Formula: C11D10
Molecular Weight: 152.121
Synonyms: 1-Methylnaphthalene-d10;
Density: 1.088 g/cm3
Boiling Point: 242.8 °C at 760 mmHg
Flash Point: 82.2 °C
Hazard Symbols: HarmfulXn
Risk Codes: 22-36/37/38-42/43
Safety: 7-26-36/37/39
PSA: 0.00000
LogP: 3.14820
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  • 1-METHYLNAPHTHALENE-D10  CAS NO.38072-94-5

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Specification

The CAS register number of 1-Methylnaphthalene-D10 is 38072-94-5. It also can be called as Naphthalene-1,2,3,4,5,6,7-d7,8-(methyl-d3)- and the systematic name about this chemical is 1,2,3,4,5,6,7-heptadeuterio-8-(trideuteriomethyl)naphthalene. The molecular formula about this chemical is C11D10 and molecular weight is 152.26. It belongs to the following product categories, such as Alphabetical Listings; Stable Isotopes; M and so on.

Physical properties about 1-Methylnaphthalene-D10 are: (1)ACD/LogP: 3.91; (2)ACD/LogD (pH 5.5): 3.91; (3)ACD/LogD (pH 7.4): 3.91; (4)ACD/BCF (pH 5.5): 550.66; (5)ACD/BCF (pH 7.4): 550.66; (6)ACD/KOC (pH 5.5): 3188.07; (7)ACD/KOC (pH 7.4): 3188.07; (8)Index of Refraction: 1.616; (9)Molar Refractivity: 48.92 cm3; (10)Molar Volume: 139.8 cm3; (11)Polarizability: 19.39x10-24cm3; (12)Surface Tension: 38.7 dyne/cm; (13)Flash Point: 82.2 °C; (14)Enthalpy of Vaporization: 46.03 kJ/mol; (15)Boiling Point: 242.8 °C at 760 mmHg; (16)Vapour Pressure: 0.0518 mmHg at 25°C.

Preparation: this chemical can be prepared by 1-methyl-naphthalene. This reaction will need reagent deuterium oxide, sodium deuteroxide. The reaction time is 24 hour(s) with reaction temperature of 420 - 430 ℃. The yield is about 75%.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed and it is irritating to eyes, respiratory system and skin, it may cause sensitization by inhalation and skin contact. When you are using it, wear suitable protective clothing, gloves and eye/face protection, you also need keep container tightly closed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cccc2c1cccc2
(2)InChI: InChI=1/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3/i1D3,2D,3D,4D,5D,6D,7D,8D
(3)InChIKey: QPUYECUOLPXSFR-UZHHFJDZES
(4)Std. InChI: InChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3/i1D3,2D,3D,4D,5D,6D,7D,8D
(5)Std. InChIKey: QPUYECUOLPXSFR-UZHHFJDZSA-N