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Home> Hot Product Listed 7   > 7H-Pyrrolo[2,3-d]pyrimidine,5-bromo-

7H-Pyrrolo[2,3-d]pyrimidine,5-bromo-

CAS No.:175791-49-8
Molecular Weight:0
Molecular Formula:C6H4BrN3 (Products with the same molecular formula)
MOL File:175791-49-8.mol
Names and Identifiers
Synonyms

7H-Pyrrolo[2,3-d]pyrimidine,5-bromo-1H-Pyrrolo[2,3-d]pyrimidine,5-bromo- (9CI)

Inchi
InChI=1/C6H4BrN3/c7-5-2-9-6-4(5)1-8-3-10-6/h1-3H,(H,8,9,10)
Properties
Density
1.895 g/cm3
Refractive Index
1.746
Safety and Handling
Specification

The cas register number of 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine is 175791-49-8. It also can be called as 7H-Pyrrolo[2,3-d]pyrimidine,5-bromo- and the Systematic name about this chemical is 5-bromo-7H-pyrrolo[2,3-d]pyrimidine. It belongs to the Chiral chemicals.

Physical properties about 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine are: (1)ACD/LogP: 1.44; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 37; (5)ACD/KOC (pH 7.4): 37; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)Polar Surface Area: 41.57Å2; (9)Index of Refraction: 1.746; (10)Molar Refractivity: 42.401 cm3; (11)Molar Volume: 104.504 cm3; (12)Polarizability: 16.809x10-24cm3; (13)Surface Tension: 76.935 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2c1cncnc1nc2
(2)InChI: InChI=1/C6H4BrN3/c7-5-2-9-6-4(5)1-8-3-10-6/h1-3H,(H,8,9,10)
(3)InChIKey: CMXNUWNEWCACQH-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C6H4BrN3/c7-5-2-9-6-4(5)1-8-3-10-6/h1-3H,(H,8,9,10)
(5)Std. InChIKey: CMXNUWNEWCACQH-UHFFFAOYSA-N

Precursor and Product
precursor:
271-70-5
271-70-5
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