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(6S)-6-methyl-7-(oxan-2-yloxy)heptan-2-one

(6S)-6-methyl-7-(oxan-2-yloxy)heptan-2-one

Formula: C13H24O3

SMILES: C[C@@H](CCCC(C)=O)COC1CCCCO1

IUPAC: (6S)-6-methyl-7-(oxan-2-yloxy)heptan-2-one

InChI: InChI=1S/C13H24O3/c1-11(6-5-7-12(2)14)10-16-13-8-3-4-9-15-13/h11,13H,3-10H2,1-2H3/t11-,13?/m0/s1

Composition: C (68.38%), H (10.60%), O (21.02%)

Molar Mass: 228.332

Atom Count: 40

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 228.172544633
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey QATYWYWXGPNTNI-AMGKYWFPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.81
Topological Polar Surface Area 35.53
Polarizability 25.4
Ring Count 1
Rotatable Bond Count 7

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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H24O3 $2,860.00-$3,496.00$2,860.00$3,496.00
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