4-Pyrimidinamine,5-chloro-6-methyl- supplier

Name
Pyrimidine, 4-amino-5-chloro-6-methyl- (7CI,8CI)
EINECS
CAS No. 13040-89-6
Density 1.35g/cm³
Solubility
Melting Point
Formula C₅H₆ClN₃
Boiling Point 265.421 °C at 760 mmHg
Molecular Weight 143.576
Flash Point 114.323 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Chloro-6-methyl-4-pyrimidinamine;Pyrimidine,4-amino-5-chloro-6-methyl- (7CI,8CI);
PSA 51.80000
LogP 1.60180

4-Pyrimidinamine,5-chloro-6-methyl- Specification

The 4-Pyrimidinamine,5-chloro-6-methyl-, with CAS registry number 13040-89-6, belongs to the following product category: Pyrimidine. It has the systematic name of 5-chloro-6-methyl-pyrimidin-4-amine. Besides this, it is also called Pyrimidine, 4-amino-5-chloro-6-methyl- (7CI,8CI). And the chemical formula of this chemical is C₅H₆ClN₃.

Physical properties of 4-Pyrimidinamine,5-chloro-6-methyl-: (1)ACD/LogP: 0.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.365; (4)ACD/LogD (pH 7.4): 0.377; (5)ACD/BCF (pH 5.5): 1.107; (6)ACD/BCF (pH 7.4): 1.139; (7)ACD/KOC (pH 5.5): 37.122; (8)ACD/KOC (pH 7.4): 38.208; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 51.8 Å²; (13)Index of Refraction: 1.6; (14)Molar Refractivity: 36.391 cm³; (15)Molar Volume: 106.387 cm³; (16)Polarizability: 14.427×10^-24cm³; (17)Surface Tension: 59.053 dyne/cm; (18)Density: 1.35 g/cm³; (19)Flash Point: 114.323 °C; (20)Enthalpy of Vaporization: 50.335 kJ/mol; (21)Boiling Point: 265.421 °C at 760 mmHg; (22)Vapour Pressure: 0.009 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(c(ncn1)N)Cl
(2)InChI: InChI=1/C5H6ClN3/c1-3-4(6)5(7)9-2-8-3/h2H,1H3,(H2,7,8,9)
(3)InChIKey: LTRUFLKTFQXHEC-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C5H6ClN3/c1-3-4(6)5(7)9-2-8-3/h2H,1H3,(H2,7,8,9)
(5)Std. InChIKey: LTRUFLKTFQXHEC-UHFFFAOYSA-N

Product Name

Pyrimidine, 4-amino-5-chloro-6-methyl- (7CI,8CI)

4-Pyrimidinamine,5-chloro-6-methyl- Specification

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