4-Dimethoxymethylpyrimidine supplier

Name
4-(DIMETHOXYMETHYL)PYRIMIDINE
EINECS
CAS No. 25746-87-6
Article Data3
CAS DataBase
Density 1.112 g/cm³
Solubility
Melting Point
Formula C₇H₁₀ N₂ O₂
Boiling Point 196.822 °C at 760 mmHg
Molecular Weight 154.169
Flash Point 70.568 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 4-Pyrimidinecarboxaldehyde,dimethyl acetal (8CI);4-Dimethoxymethylpyrimidine;4-(dimethoxymethyl)pyrimidine;
PSA 44.24000
LogP 0.76800

4-Dimethoxymethylpyrimidine Specification

The Pyrimidine, 4-(dimethoxymethyl)-, with the cas registry number 25746-87-6, has the IUPAC name of 4-(dimethoxymethyl)pyrimidine. And it belongs to the product categories of API intermediates.

The physical properties of this chemical are as follows: (1)ACD/LogP: 0.36; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 16; (6)ACD/KOC (pH 7.4): 16; (7)#H bond acceptors: 4; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 44.24; (11)Index of Refraction: 1.49; (12)Molar Refractivity: 40.111 cm³; (13)Molar Volume: 138.678 cm³; (14)Polarizability: 15.901× 10^-24cm³; (15)Surface Tension: 40.549 dyne/cm; (16)Density: 1.112 g/cm³; (17)Flash Point: 70.568 °C; (18)Enthalpy of Vaporization: 41.531 kJ/mol; (19)Boiling Point: 196.822 °C at 760 mmHg; (20)Vapour Pressure: 0.549 mmHg at 25°C; (21)Exact Mass: 154.074228; (22)MonoIsotopic Mass: 154.074228; (23)Topological Polar Surface Area: 44.2; (24)Heavy Atom Count: 11; (25)Formal Charge: 0; (26)Complexity: 107.

When dealing with this chemical, you should be careful. For being irritating to eyes, respiratory system and skin, you should wear suitable protective clothing. And if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: COC(C1=NC=NC=C1)OC
(2)InChI: InChI=1S/C7H10N2O2/c1-10-7(11-2)6-3-4-8-5-9-6/h3-5,7H,1-2H3
(3)InChIKey: QZBWJPFALVAAPM-UHFFFAOYSA-N

Product Name

4-(DIMETHOXYMETHYL)PYRIMIDINE

4-Dimethoxymethylpyrimidine Specification

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