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39756-36-0

Basic Information
CAS No.: 39756-36-0
Name: N-NONADECANE-D40
Molecular Structure:
Molecular Structure of 39756-36-0 (N-NONADECANE-D40)
Formula: C19D40
Molecular Weight: 308.209
Synonyms: (2H40)nonadecane;
Density: 0.902 g/cm3
Melting Point: 28-30 °C(lit.)
Boiling Point: 330.1 °C at 760 mmHg
Flash Point: 168.3 °C
PSA: 0.00000
LogP: 7.65790
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Specification

The CAS register number of Nonadecane-d40 is 39756-36-0. It also can be called as (2H40)nonadecane and the systematic name about this chemical is (~2~H_40_)nonadecane. The molecular formula about this chemical is C19D40 and the molecular weight is 308.77. It belongs to the following product categories which include Alphabetical Listings; N-O; Stable Isotopes and so on.

Physical properties about Nonadecane-d40 are: (1)ACD/LogP: 10.85; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.85; (4)ACD/LogD (pH 7.4): 10.85; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)Index of Refraction: 1.439; (10)Molar Refractivity: 90.07 cm3; (11)Molar Volume: 342.1 cm3; (12)Polarizability: 35.7x10-24cm3; (13)Surface Tension: 28.1 dyne/cm; (14)Flash Point: 168.3 °C; (15)Enthalpy of Vaporization: 55 kJ/mol; (16)Boiling Point: 330.1 °C at 760 mmHg; (17)Vapour Pressure: 0.000325 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]C([2H])(C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C ([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
(2)InChI: InChI=1/C19H40/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2
(3)InChIKey: LQERIDTXQFOHKA-FZTVEWNYER
(4)Std. InChI: InChI=1S/C19H40/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2
(5)Std. InChIKey: LQERIDTXQFOHKA-FZTVEWNYSA-N