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4-methoxy-3-methyl-4-oxobutanoic acid

4-methoxy-3-methyl-4-oxobutanoic acid

Formula: C6H10O4

SMILES: COC(=O)C(C)CC(O)=O

IUPAC: 4-methoxy-3-methyl-4-oxobutanoic acid

InChI: InChI=1/C6H10O4/c1-4(3-5(7)8)6(9)10-2/h4H,3H2,1-2H3,(H,7,8)

Composition: C (49.31%), H (6.90%), O (43.79%)

Molar Mass: 146.142

Atom Count: 20

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 146.057908802
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QEZMQNIFDRNSJZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 32.88
Topological Polar Surface Area 63.6
Polarizability 13.2
Ring Count 0
Rotatable Bond Count 4

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C6H10O4 Quote Only