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5,6-dichloropyrazine-2-carboxylic acid

5,6-dichloropyrazine-2-carboxylic acid

CAS: 76537-42-3

Formula: C5H2Cl2N2O2

SMILES: OC(=O)C1=NC(Cl)=C(Cl)N=C1

IUPAC: 5,6-dichloropyrazine-2-carboxylic acid

InChI: InChI=1S/C5H2Cl2N2O2/c6-3-4(7)9-2(1-8-3)5(10)11/h1H,(H,10,11)

Composition: C (31.12%), H (1.04%), Cl (36.74%), N (14.52%), O (16.58%)

Molar Mass: 192.98

Atom Count: 13

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 191.9493327
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VVZNBAQAYLMLGO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.36
Topological Polar Surface Area 63.08
Polarizability 15.11
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 76537-42-3 $272.03-$987.62$272.03$272.03$403.13$403.13$987.62$987.62
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