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ethyl 5-methoxypyridine-3-carboxylate

ethyl 5-methoxypyridine-3-carboxylate

CAS: 20826-01-1

Formula: C9H11NO3

SMILES: CCOC(=O)C1=CC(OC)=CN=C1

IUPAC: ethyl 5-methoxypyridine-3-carboxylate

InChI: InChI=1S/C9H11NO3/c1-3-13-9(11)7-4-8(12-2)6-10-5-7/h4-6H,3H2,1-2H3

Composition: C (59.66%), H (6.12%), N (7.73%), O (26.49%)

Molar Mass: 181.191

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 181.073893218
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey AHFHVMVXWINXKJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.14
Topological Polar Surface Area 48.42
Polarizability 18.24
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 20826-01-1 $1,860.00-$3,850.00$1,860.00$2,750.00$3,850.00
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