7H-Pyrrolo[2,3-d]pyrimidin-2-amine supplier

Name
1H-Pyrrolo[2,3-d]pyrimidin-2-amine (9CI)
EINECS
CAS No. 93366-88-2
Article Data6
CAS DataBase
Density 1.619 g/cm³
Solubility
Melting Point
Formula C₆H₆N₄
Boiling Point 359.786 °C at 760 mmHg
Molecular Weight 134.14
Flash Point 171.393 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Pyrrolo[2,3-d]pyrimidin-2-amine(9CI);2-Amino-7H-pyrrolo[2,3-d]pyrimidine;
PSA 68.32000
LogP 0.47020

7H-Pyrrolo[2,3-d]pyrimidin-2-amine Specification

The CAS registry number of 7H-Pyrrolo[2,3-d]pyrimidin-2-amine is 93366-88-2. The systematic name is 1H-pyrrolo[2,3-d]pyrimidin-2-amine. In addition, the molecular formula is C₆H₆N₄ and the molecular weight is 134.14. What's more, it belongs to the class of Pyrimidine and should be stored in a cool and dry place.

Physical properties about 7H-Pyrrolo[2,3-d]pyrimidin-2-amine are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 6.239; (4)ACD/KOC (pH 7.4): 6.273; (5)#H bond acceptors: 4; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 62.77 Å²; (9)Index of Refraction: 1.824; (10)Molar Refractivity: 36.171 cm³; (11)Molar Volume: 82.831 cm³; (12)Polarizability: 14.339 ×10^-24cm³; (13)Surface Tension: 73.897 dyne/cm; (14)Density: 1.619 g/cm³; (15)Flash Point: 171.393 °C; (16)Enthalpy of Vaporization: 60.542 kJ/mol; (17)Boiling Point: 359.786 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cnc-2[nH]c(ncc12)N
(2)InChI: InChI=1/C6H6N4/c7-6-9-3-4-1-2-8-5(4)10-6/h1-3H,(H3,7,8,9,10)
(3)InChIKey: YVVMIGRXQRPSIY-UHFFFAOYAL

Product Name

1H-Pyrrolo[2,3-d]pyrimidin-2-amine (9CI)

7H-Pyrrolo[2,3-d]pyrimidin-2-amine Specification

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