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4-Chloro-2,6-dimethyl-3-nitropyridine

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Name

4-Chloro-2,6-dimethyl-3-nitropyridine

EINECS -0
CAS No. 15513-48-1 Density 1.342 g/cm3
PSA 58.71000 LogP 2.78320
Solubility N/A Melting Point 70-73℃
Formula C7H7ClN2O2 Boiling Point 270.291 °C at 760 mmHg
Molecular Weight 186.598 Flash Point 117.268 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15513-48-1 (4-Chloro-2,6-dimethyl-3-nitropyridine) Hazard Symbols N/A
Synonyms

2,6-Lutidine,4-chloro-3-nitro- (7CI,8CI);4-Chloro-2,6-dimethyl-3-nitropyridine;4-Chloro-3-nitro-2,6-lutidine;

Article Data 9

4-Chloro-2,6-dimethyl-3-nitropyridine Specification

The 4-Chloro-2,6-dimethyl-3-nitropyridine with the CAS number 15513-48-1 is also called Pyridine,4-chloro-2,6-dimethyl-3-nitro-. Its molecular formula is C7H7ClN2O2. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 4-Chloro-2,6-dimethyl-3-nitropyridine are: (1)ACD/LogP: 1.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 12; (6)ACD/BCF (pH 7.4): 12; (7)ACD/KOC (pH 5.5): 206; (8)ACD/KOC (pH 7.4): 206; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 58.71 Å2; (13)Index of Refraction: 1.567; (14)Molar Refractivity: 45.435 cm3; (15)Molar Volume: 139 cm3; (16)Polarizability: 18.012×10-24cm3; (17)Surface Tension: 49.162 dyne/cm; (18)Enthalpy of Vaporization: 48.799 kJ/mol; (19)Vapour Pressure: 0.011 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=N(=O)c1c(Cl)cc(C)nc1C
(2)InChI: InChI=1/C7H7ClN2O2/c1-4-3-6(8)7(10(11)12)5(2)9-4/h3H,1-2H3
(3)InChIKey: PSBGFLWVQDGETK-UHFFFAOYAA

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