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ethyl oct-2-ynoate

ethyl oct-2-ynoate

CAS: 10519-20-7

Formula: C10H16O2

SMILES: CCCCCC#CC(=O)OCC

IUPAC: ethyl oct-2-ynoate

InChI: InChI=1S/C10H16O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-7H2,1-2H3

Composition: C (71.39%), H (9.59%), O (19.02%)

Molar Mass: 168.236

Atom Count: 28

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 168.115029755
Formal Charge 0
FSP3 0.7
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey QPMDWYXUSMRVKT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.21
Topological Polar Surface Area 26.3
Polarizability 18.81
Ring Count 0
Rotatable Bond Count 7

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Purity LeadTime CAS UnitPrice
98% <14 Days 10519-20-7 Quote Only