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ethyl 6-(methylamino)pyridazine-3-carboxylate

ethyl 6-(methylamino)pyridazine-3-carboxylate

CAS: 365413-16-7

Formula: C8H11N3O2

SMILES: CCOC(=O)C1=CC=C(NC)N=N1

IUPAC: ethyl 6-(methylamino)pyridazine-3-carboxylate

InChI: InChI=1S/C8H11N3O2/c1-3-13-8(12)6-4-5-7(9-2)11-10-6/h4-5H,3H2,1-2H3,(H,9,11)

Composition: C (53.03%), H (6.12%), N (23.19%), O (17.66%)

Molar Mass: 181.195

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 181.085126606
Formal Charge 0
FSP3 0.37
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey MBRXPNIOOHRVMY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.67
Topological Polar Surface Area 64.11
Polarizability 17.85
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 365413-16-7 $63.05$63.05
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