4-Pyrimidinamine,2-methyl- supplier

Name
4-Pyrimidinamine, 2-methyl- (9CI)
EINECS 205-525-8
CAS No. 74-69-1
Article Data2
CAS DataBase
Density 1.156 g/cm³
Solubility
Melting Point 204-205℃
Formula C₅H₇N₃
Boiling Point 222.186 °C at 760 mmHg
Molecular Weight 109.131
Flash Point 110.702 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 22-37/38-41
Molecular Structure
Hazard Symbols Xn
Synonyms Pyrimidine,4-amino-2-methyl- (6CI,7CI,8CI);2-Methyl-4-aminopyrimidine;2-Methyl-4-pyrimidinamine;4-Amino-2-methylpyrimidine;NSC 165370;4-pyrimidinamine, 2-methyl-;
PSA 51.80000
LogP 0.94840

4-Pyrimidinamine,2-methyl- Specification

The 4-Pyrimidinamine,2-methyl-, with the CAS registry number 74-69-1, has the systematic name of 2-methylpyrimidin-4-amine. It belongs to the product category of Pyrimidine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₅H₇N₃.

The characteristics of 4-Pyrimidinamine,2-methyl- are as followings: (1)ACD/LogP: 0.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.026; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 6.231; (7)ACD/KOC (pH 7.4): 24.2; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 51.8 Å²; (12)Index of Refraction: 1.582; (13)Molar Refractivity: 31.496 cm³; (14)Molar Volume: 94.436 cm³; (15)Polarizability: 12.486×10^-24cm³; (16)Surface Tension: 56.619 dyne/cm; (17)Density: 1.156 g/cm³; (18)Flash Point: 110.702 °C; (19)Enthalpy of Vaporization: 45.864 kJ/mol; (20)Boiling Point: 222.186 °C at 760 mmHg; (21)Vapour Pressure: 0.103 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1nccc(n1)N
(2)InChI: InChI=1/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8)
(3)InChIKey: GKVDLTTVBNOGNJ-UHFFFAOYAH

Product Name

4-Pyrimidinamine, 2-methyl- (9CI)

4-Pyrimidinamine,2-methyl- Specification

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