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penta-1,4-diyn-3-ol

penta-1,4-diyn-3-ol

CAS: 56598-53-9

Formula: C5H4O

SMILES: OC(C#C)C#C

IUPAC: penta-1,4-diyn-3-ol

InChI: InChI=1S/C5H4O/c1-3-5(6)4-2/h1-2,5-6H

Composition: C (74.99%), H (5.03%), O (19.98%)

Molar Mass: 80.086

Atom Count: 10

Heavy Atom Count: 6

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 80.026214749
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey BKDYPNZJRPEUEI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 23.09
Topological Polar Surface Area 20.23
Polarizability 8.37
Ring Count 0
Rotatable Bond Count 0

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