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methyl 2,5-dichloropyrimidine-4-carboxylate

methyl 2,5-dichloropyrimidine-4-carboxylate

Formula: C6H4Cl2N2O2

SMILES: COC(=O)C1=NC(Cl)=NC=C1Cl

IUPAC: methyl 2,5-dichloropyrimidine-4-carboxylate

InChI: InChI=1S/C6H4Cl2N2O2/c1-12-5(11)4-3(7)2-9-6(8)10-4/h2H,1H3

Composition: C (34.81%), H (1.95%), Cl (34.25%), N (13.53%), O (15.46%)

Molar Mass: 207.01

Atom Count: 16

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 205.9649828
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey MUJBXSCSNLVZNS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.68
Topological Polar Surface Area 52.08
Polarizability 17.12
Ring Count 1
Rotatable Bond Count 2

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98% <10 Days C6H4Cl2N2O2 Quote Only
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