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3-methoxypropanoic acid

3-methoxypropanoic acid

CAS: 2544-06-1

Formula: C4H8O3

SMILES: COCCC(O)=O

IUPAC: 3-methoxypropanoic acid

InChI: InChI=1S/C4H8O3/c1-7-3-2-4(5)6/h2-3H2,1H3,(H,5,6)

Composition: C (46.15%), H (7.75%), O (46.10%)

Molar Mass: 104.105

Atom Count: 15

Heavy Atom Count: 7

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 104.047344118
Formal Charge 0
FSP3 0.75
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey YSIKHBWUBSFBRZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 23.8
Topological Polar Surface Area 46.53
Polarizability 9.41
Ring Count 0
Rotatable Bond Count 3

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