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3-(pyridin-2-yl)prop-2-yn-1-ol

3-(pyridin-2-yl)prop-2-yn-1-ol

CAS: 29768-03-4

Formula: C8H7NO

SMILES: OCC#CC1=CC=CC=N1

IUPAC: 3-(pyridin-2-yl)prop-2-yn-1-ol

InChI: InChI=1S/C8H7NO/c10-7-3-5-8-4-1-2-6-9-8/h1-2,4,6,10H,7H2

Composition: C (72.17%), H (5.30%), N (10.52%), O (12.02%)

Molar Mass: 133.15

Atom Count: 17

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 133.052763849
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JBTFIWAQYSBSEZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 35.98
Topological Polar Surface Area 33.12
Polarizability 14.47
Ring Count 1
Rotatable Bond Count 2

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