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6-isopropoxypyridine-3-carbaldehyde

6-isopropoxypyridine-3-carbaldehyde

CAS: 884495-35-6

Formula: C9H11NO2

SMILES: CC(C)OC1=NC=C(C=O)C=C1

IUPAC: 6-(propan-2-yloxy)pyridine-3-carbaldehyde

InChI: InChI=1S/C9H11NO2/c1-7(2)12-9-4-3-8(6-11)5-10-9/h3-7H,1-2H3

Composition: C (65.44%), H (6.71%), N (8.48%), O (19.37%)

Molar Mass: 165.192

Atom Count: 23

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 165.078978598
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey BNNHZEKFKMAUEZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.43
Topological Polar Surface Area 39.19
Polarizability 17.53
Ring Count 1
Rotatable Bond Count 3

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