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methyl 2-hydroxybut-3-enoate

methyl 2-hydroxybut-3-enoate

CAS: 5837-73-0

Formula: C5H8O3

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

IUPAC: methyl 2-hydroxybut-3-enoate

InChI: InChI=1/C5H8O3/c1-3-4(6)5(7)8-2/h3-4,6H,1H2,2H3

Composition: C (51.72%), H (6.94%), O (41.34%)

Molar Mass: 116.116

Atom Count: 16

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 116.047344118
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JBKTVPSFVUFSAO-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 28.02
Topological Polar Surface Area 46.53
Polarizability 11.14
Ring Count 0
Rotatable Bond Count 3

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