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sodium pyrimidine-2-carboxylic acid

sodium pyrimidine-2-carboxylic acid

CAS: 562101-38-6

Formula: C5H4N2NaO2

SMILES: [Na+].OC(=O)C1=NC=CC=N1

IUPAC: sodium pyrimidine-2-carboxylic acid

InChI: InChI=1S/C5H4N2O2.Na/c8-5(9)4-6-2-1-3-7-4;/h1-3H,(H,8,9);/q;+1

Composition: C (40.83%), H (2.74%), N (19.05%), Na (15.63%), O (21.75%)

Molar Mass: 147.088

Atom Count: 14

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 147.01649808
Formal Charge 1
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey JAYHOLAWADPIFN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 29.64
Topological Polar Surface Area 63.08
Polarizability 10.98
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 562101-38-6 $1,540.00-$2,860.00$1,540.00$1,760.00$2,860.00
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