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3-bromo-5,7-dichloro-1H-pyrazolo[4,3-d]pyrimidine

3-bromo-5,7-dichloro-1H-pyrazolo[4,3-d]pyrimidine

CAS: 1934543-12-0

Formula: C5HBrCl2N4

SMILES: ClC1=NC(Cl)=C2NN=C(Br)C2=N1

IUPAC: 3-bromo-5,7-dichloro-1H-pyrazolo[4,3-d]pyrimidine

InChI: InChI=1S/C5HBrCl2N4/c6-3-1-2(11-12-3)4(7)10-5(8)9-1/h(H,11,12)

Composition: C (22.42%), H (0.38%), Br (29.83%), Cl (26.47%), N (20.91%)

Molar Mass: 267.9

Atom Count: 13

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 265.876164
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey IUVXUHIFNUFWDT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.2
Topological Polar Surface Area 54.46
Polarizability 19.98
Ring Count 2
Rotatable Bond Count 0

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95% <5 Days 1934543-12-0 $98.36-$263.55$98.36$156.36$263.55
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