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3-chloropyrazine-2-carboxylic acid

3-chloropyrazine-2-carboxylic acid

CAS: 27398-39-6

Formula: C5H3ClN2O2

SMILES: OC(=O)C1=C(Cl)N=CC=N1

IUPAC: 3-chloropyrazine-2-carboxylic acid

InChI: InChI=1S/C5H3ClN2O2/c6-4-3(5(9)10)7-1-2-8-4/h1-2H,(H,9,10)

Composition: C (37.88%), H (1.91%), Cl (22.36%), N (17.67%), O (20.18%)

Molar Mass: 158.54

Atom Count: 13

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 157.988305
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey PMRPVXLESNMKLG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.49
Topological Polar Surface Area 63.08
Polarizability 13.04
Ring Count 1
Rotatable Bond Count 1

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AA BLOCKS INC
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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 27398-39-6 $9.20-$335.80$9.20$14.95$36.80$65.55$127.65$335.80
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Key Organics Ltd
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90% <2 Days 27398-39-6 $51.35-$86.31$51.35$63.37$86.31
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Struchem co.,ltd
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95% <5 Days 27398-39-6 $628.00-$775.00$628.00$775.00
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Kinentia Biosciences LLC
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97% <14 Days 27398-39-6 $107.73-$404.46$107.73$404.46
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LabNetwork INC
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95% 1 Day 27398-39-6 $257.19$257.19
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