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Name |
2-Chlorotoluene-3,4,5,6-D4 |
EINECS | N/A |
CAS No. | 362049-57-8 | Density | N/A |
PSA | 0.00000 | LogP | 2.64840 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H3 Cl D4 | Boiling Point | N/A |
Molecular Weight | 130.61 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-CHLOROTOLUENE-3,4,5,6-D4 |
Molecular Structure of 2-Chlorotoluene-3,4,5,6-D4 (CAS NO.362049-57-8):
Systematic Name: 1-Chloro-2-methyl(~2~H_4_)benzene
Molecular Formula: C7H3ClD4
Molecular Weight: 130.61
Mol File: 362049-57-8.mol
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 0
Index of Refraction: 1.524
Molar Refractivity: 35.973 cm3
Molar Volume: 117.659 cm3
Surface Tension: 32.435 dyne/cm
Density: 1.11 g/cm3
Flash Point: 47.222 °C
Enthalpy of Vaporization: 37.673 kJ/mol
Boiling Point: 156.189 °C at 760 mmHg
Vapour Pressure: 3.77 mmHg at 25 °C
SMILES: [2H]c1c(c(c(c(c1[2H])C)Cl)[2H])[2H]
InChI: InChI=1/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3/i2D,3D,4D,5D
InChIKey: IBSQPLPBRSHTTG-QFFDRWTDEE
2-Chlorotoluene-3,4,5,6-D4 (CAS NO.362049-57-8), its Synonyms are Benzene-1,2,3,4-d4,5-chloro-6-methyl- (9CI) ; Benzene-1,2,3,4-d_4_, 5-chloro-6-methyl- .