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4-ethynyloxan-4-ol

4-ethynyloxan-4-ol

CAS: 57385-16-7

Formula: C7H10O2

SMILES: OC1(CCOCC1)C#C

IUPAC: 4-ethynyloxan-4-ol

InChI: InChI=1S/C7H10O2/c1-2-7(8)3-5-9-6-4-7/h1,8H,3-6H2

Composition: C (66.65%), H (7.99%), O (25.36%)

Molar Mass: 126.155

Atom Count: 19

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 126.068079562
Formal Charge 0
FSP3 0.71
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey SWJWVPMUAUALKX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.21
Topological Polar Surface Area 29.46
Polarizability 13.12
Ring Count 1
Rotatable Bond Count 0

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