Text Search
Structure Search

4-(pyridin-2-yl)but-3-yn-1-ol

4-(pyridin-2-yl)but-3-yn-1-ol

CAS: 395652-44-5

Formula: C9H9NO

SMILES: OCCC#CC1=CC=CC=N1

IUPAC: 4-(pyridin-2-yl)but-3-yn-1-ol

InChI: InChI=1S/C9H9NO/c11-8-4-2-6-9-5-1-3-7-10-9/h1,3,5,7,11H,4,8H2

Composition: C (73.45%), H (6.16%), N (9.52%), O (10.87%)

Molar Mass: 147.177

Atom Count: 20

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 147.068413914
Formal Charge 0
FSP3 0.22
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WYJPBKGKJJFGPR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.73
Topological Polar Surface Area 33.12
Polarizability 16.31
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 395652-44-5 $45.40-$704.90$45.40$112.23$384.61$704.90
Request Quote