CAS No.3177-20-6,Methyl2,4-Dichloropyrimidine-5-carboxylate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	3177-20-6
Name:	Methyl2,4-Dichloropyrimidine-5-carboxylate
Article Data:	10

Formula:	C₆H₄Cl₂N₂O₂
Molecular Weight:	207.016
Synonyms:	2,4-Dichloropyrimidine-5-carboxylicacid methyl ester;Methyl 2,4-dichloro-5-pyrimidinecarboxylate;
Density:	1.503 g/cm³
Melting Point:	30-34 °C
Boiling Point:	299.3 °C at 760 mmHg
Flash Point:	134.8 °C
Hazard Symbols:	Xn
Risk Codes:	26-36/37/38
Safety:	26
PSA:	52.08000
LogP:	1.57000

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Specification

The CAS register number of Methyl 2,4-dichloropyrimidine-5-carboxylate is 3177-20-6. It also can be called as 5-Pyrimidinecarboxylicacid, 2,4-dichloro-, methyl ester and the systematic name about this chemical is methyl 2,4-dichloropyrimidine-5-carboxylate. The molecular formula about this chemical is C₆H₄Cl₂N₂O₂and the molecular weight is 207.01. It belongs to the Pharmacetical.

Physical properties about Methyl 2,4-dichloropyrimidine-5-carboxylate are: (1)ACD/LogP: 1.36; (2)ACD/LogD (pH 5.5): 1.36; (3)ACD/LogD (pH 7.4): 1.36; (4)ACD/BCF (pH 5.5): 6.39; (5)ACD/BCF (pH 7.4): 6.39; (6)ACD/KOC (pH 5.5): 131.32; (7)ACD/KOC (pH 7.4): 131.32; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 52.08Å²; (11)Index of Refraction: 1.552; (12)Molar Refractivity: 43.99 cm³; (13)Molar Volume: 137.6 cm³; (14)Polarizability: 17.44x10^-24cm³; (15)Surface Tension: 53.3 dyne/cm; (16)Flash Point: 134.8 °C; (17)Enthalpy of Vaporization: 53.93 kJ/mol; (18)Boiling Point: 299.3 °C at 760 mmHg; (19)Vapour Pressure: 0.0012 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is very toxic by inhalation. It is irritating to eyes, respiratory system and skin. 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: Clc1nc(Cl)ncc1C(=O)OC
(2)InChI: InChI=1/C6H4Cl2N2O2/c1-12-5(11)3-2-9-6(8)10-4(3)7/h2H,1H3
(3)InChIKey: FNNAWVXVOHNOFF-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C6H4Cl2N2O2/c1-12-5(11)3-2-9-6(8)10-4(3)7/h2H,1H3
(5)Std. InChIKey: FNNAWVXVOHNOFF-UHFFFAOYSA-N