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methyl 3,3-dimethoxypropanoate

methyl 3,3-dimethoxypropanoate

CAS: 7424-91-1

Formula: C6H12O4

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

IUPAC: methyl 3,3-dimethoxypropanoate

InChI: InChI=1S/C6H12O4/c1-8-5(7)4-6(9-2)10-3/h6H,4H2,1-3H3

Composition: C (48.64%), H (8.16%), O (43.19%)

Molar Mass: 148.158

Atom Count: 22

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 148.073558866
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey SMCVPMKCDDNUCQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.35
Topological Polar Surface Area 44.76
Polarizability 14.03
Ring Count 0
Rotatable Bond Count 5

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