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4-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-amine

4-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-amine

Formula: C6H5ClN4

SMILES: NC1=CNC2=NC=NC(Cl)=C12

IUPAC: 4-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-amine

InChI: InChI=1S/C6H5ClN4/c7-5-4-3(8)1-9-6(4)11-2-10-5/h1-2H,8H2,(H,9,10,11)

Composition: C (42.75%), H (2.99%), Cl (21.03%), N (33.23%)

Molar Mass: 168.58

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 168.0202739
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey KAUCHHKKEDFVMC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.33
Topological Polar Surface Area 67.59
Polarizability 16.2
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C6H5ClN4 $2,524.50-$3,006.03$2,524.50$2,643.25$2,764.80$2,884.48$3,006.03
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98% <10 Days C6H5ClN4 Quote Only
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