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oxiran-2-ylmethyl 2-ethyl-2,5-dimethylhexanoate

oxiran-2-ylmethyl 2-ethyl-2,5-dimethylhexanoate

CAS: 26761-45-5

Formula: C13H24O3

SMILES: CCC(C)(CCC(C)C)C(=O)OCC1CO1

IUPAC: (oxiran-2-yl)methyl 2-ethyl-2,5-dimethylhexanoate

InChI: InChI=1/C13H24O3/c1-5-13(4,7-6-10(2)3)12(14)16-9-11-8-15-11/h10-11H,5-9H2,1-4H3

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 2
Hydrogen Bond Donor Count 0
InChIKey DHEHEJGXTUCSQF-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.81
Topological Polar Surface Area 38.83
Polarizability 25.4
Ring Count 1
Rotatable Bond Count 8

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Purity LeadTime CAS UnitPrice
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Purity LeadTime CAS PacketSize UnitPrice
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