Thieno[2,3-d]pyrimidin-4-ylamine supplier

Name
Thieno[2,3-d]pyrimidin-4-amine
EINECS
CAS No. 14080-56-9
Density 1.485 g/cm³
Solubility
Melting Point 234-236 °C
Formula C₆H₅N₃S
Boiling Point 346.8 °C at 760 mmHg
Molecular Weight 151.192
Flash Point 163.5 °C
Transport Information
Appearance
Safety 26-45
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms Thieno[2,3-d]pyrimidine,4-amino- (8CI);4-Aminothieno[2,3-d]pyrimidine;Thieno[2,3-d]pyrimidin-4-ylamine;
PSA 80.04000
LogP 1.85470

Thieno[2,3-d]pyrimidin-4-ylamine Specification

This chemical is called Thieno[2,3-d]pyrimidin-4-ylamine, and it can also be named as 4-Aminothieno[2,3-d]pyrimidine. With the molecular formula of C₆H₅N₃S, its molecular weight is 151.19. The CAS registry number of this chemical is 14080-56-9.

Other characteristics of the Thieno[2,3-d]pyrimidin-4-ylamine can be summarised as followings: (1)ACD/LogP: 1.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.14; (4)ACD/LogD (pH 7.4): 1.24; (5)ACD/BCF (pH 5.5): 4.11; (6)ACD/BCF (pH 7.4): 5.19; (7)ACD/KOC (pH 5.5): 89.45; (8)ACD/KOC (pH 7.4): 112.99; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 57.26 Å²; (13)Index of Refraction: 1.785; (14)Molar Refractivity: 42.89 cm³; (15)Molar Volume: 101.7 cm³; (16)Polarizability: 17×10^-24cm³; (17)Surface Tension: 84.3 dyne/cm; (18)Density: 1.485 g/cm³; (19)Flash Point: 163.5 °C; (20)Enthalpy of Vaporization: 59.1 kJ/mol; (21)Boiling Point: 346.8 °C at 760 mmHg; (22)Vapour Pressure: 5.62E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Nc1ncnc2sccc12
2.InChI: InChI=1/C6H5N3S/c7-5-4-1-2-10-6(4)9-3-8-5/h1-3H,(H2,7,8,9)
3.InChIKey: DYTQGJLVGDSCLF-UHFFFAOYAB

Product Name

Thieno[2,3-d]pyrimidin-4-amine

Thieno[2,3-d]pyrimidin-4-ylamine Specification

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