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1,5-diethyl 2-methyl-3-oxopentanedioate

1,5-diethyl 2-methyl-3-oxopentanedioate

CAS: 16631-18-8

Formula: C10H16O5

SMILES: CCOC(=O)CC(=O)C(C)C(=O)OCC

IUPAC: 1,5-diethyl 2-methyl-3-oxopentanedioate

InChI: InChI=1/C10H16O5/c1-4-14-9(12)6-8(11)7(3)10(13)15-5-2/h7H,4-6H2,1-3H3

Composition: C (55.55%), H (7.46%), O (36.99%)

Molar Mass: 216.233

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 216.099773615
Formal Charge 0
FSP3 0.7
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey FCKSNVVXZMPTAQ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.49
Topological Polar Surface Area 69.67
Polarizability 20.86
Ring Count 0
Rotatable Bond Count 8

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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 16631-18-8 $370.53-$1,311.35$370.53$569.25$1,311.35
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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 16631-18-8 $279.45-$1,037.30$279.45$439.30$1,037.30
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