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methyl 4-phenylpyrimidine-2-carboxylate

methyl 4-phenylpyrimidine-2-carboxylate

Formula: C12H10N2O2

SMILES: COC(=O)C1=NC(=CC=N1)C1=CC=CC=C1

IUPAC: methyl 4-phenylpyrimidine-2-carboxylate

InChI: InChI=1S/C12H10N2O2/c1-16-12(15)11-13-8-7-10(14-11)9-5-3-2-4-6-9/h2-8H,1H3

Composition: C (67.28%), H (4.71%), N (13.08%), O (14.94%)

Molar Mass: 214.224

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 214.07422757
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey CUKXRIDBAMITNG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.17
Topological Polar Surface Area 52.08
Polarizability 23.93
Ring Count 2
Rotatable Bond Count 3

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Kinentia Biosciences LLC
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Purity LeadTime Formula PacketSize UnitPrice
97% <14 Days C12H10N2O2 $1,474.20$1,474.20
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