7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid (1016241-64-7)

The 7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid, with CAS registry number 1016241-64-7, belongs to the following product category: Chiral Chemicals. It  has the systematic name of 7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid. And the chemical formula of this chemical is C₇H₅N₃O_2. And its molecular weight is 163.13.

Physical properties of 7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid: (1)# of Rule of 5 Violations:  0; (2)#H bond acceptors:  5; (3)#H bond donors:  2; (4)#Freely Rotating Bonds:  1; (5)Polar Surface Area:  78.87 Å²; (6)Index of Refraction:  1.763; (7)Molar Refractivity:  41.64 cm³; (8)Molar Volume:  100.8 cm³; (9)Polarizability:  16.5×10^-24cm³; (10)Surface Tension:  102.8 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2cncnc2[nH]c1C(=O)O
(2)InChI: InChI=1/C7H5N3O2/c11-7(12)5-1-4-2-8-3-9-6(4)10-5/h1-3H,(H,11,12)(H,8,9,10)
(3)InChIKey: HHZKYTGSMOMGOQ-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C7H5N3O2/c11-7(12)5-1-4-2-8-3-9-6(4)10-5/h1-3H,(H,11,12)(H,8,9,10)
(5)Std. InChIKey: HHZKYTGSMOMGOQ-UHFFFAOYSA-N