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5-hexyl-4-methyloxolan-2-one

5-hexyl-4-methyloxolan-2-one

CAS: 67663-01-8

Formula: C11H20O2

SMILES: CCCCCCC1OC(=O)CC1C

IUPAC: 5-hexyl-4-methyloxolan-2-one

InChI: InChI=1/C11H20O2/c1-3-4-5-6-7-10-9(2)8-11(12)13-10/h9-10H,3-8H2,1-2H3

Composition: C (71.70%), H (10.94%), O (17.36%)

Molar Mass: 184.279

Atom Count: 33

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 184.146329884
Formal Charge 0
FSP3 0.91
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey XNRLAEXLQFIKEY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.13
Topological Polar Surface Area 26.3
Polarizability 21.02
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 67663-01-8 $73.49-$233.91$73.49$105.57$233.91
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