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Home Other Building Blocks 3-Bromo-1h-pyrazolo[3,4-d]pyrimidine

3-Bromo-1h-pyrazolo[3,4-d]pyrimidine

CAS No.:
1251033-27-8
Catalog Number:
AG000N6Z
Molecular Formula:
C5H3BrN4
Molecular Weight:
199.0081
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$80
- +
1g
95%
1 week
United States
$663
- +
Product Description
Catalog Number:
AG000N6Z
Chemical Name:
3-Bromo-1h-pyrazolo[3,4-d]pyrimidine
CAS Number:
1251033-27-8
Molecular Formula:
C5H3BrN4
Molecular Weight:
199.0081
MDL Number:
MFCD13193631
IUPAC Name:
3-bromo-2H-pyrazolo[3,4-d]pyrimidine
InChI:
InChI=1S/C5H3BrN4/c6-4-3-1-7-2-8-5(3)10-9-4/h1-2H,(H,7,8,9,10)
InChI Key:
OHDYDXVLQKCZRK-UHFFFAOYSA-N
SMILES:
Brc1n[nH]c2c1cncn2
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.954g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.011g/mol
Monoisotopic Mass:
197.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
3-Bromopyrazolo[3,4-d]pyrimidine 2'-deoxy-2'-fluoro-beta-D-arabinonucleosides: modified DNA constituents with an unusually rigid sugar N-conformation. The Journal of organic chemistry 20030711
Properties