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2-(2-methylcyclopropyl)pyrimidine-5-carboxylic acid

2-(2-methylcyclopropyl)pyrimidine-5-carboxylic acid

CAS: 1468808-18-5

Formula: C9H10N2O2

SMILES: CC1CC1C1=NC=C(C=N1)C(O)=O

IUPAC: 2-(2-methylcyclopropyl)pyrimidine-5-carboxylic acid

InChI: InChI=1/C9H10N2O2/c1-5-2-7(5)8-10-3-6(4-11-8)9(12)13/h3-5,7H,2H2,1H3,(H,12,13)

Composition: C (60.66%), H (5.66%), N (15.72%), O (17.96%)

Molar Mass: 178.191

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 178.07422757
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QNLPDVBAXSVDCW-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.55
Topological Polar Surface Area 63.08
Polarizability 17.48
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1468808-18-5 $207.00-$5,612.00$207.00$299.00$483.00$851.00$1,587.00$5,612.00
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