methyl 2-methylidene-3-oxobutanoate

methyl 2-methylidene-3-oxobutanoate

CAS: 22415-00-5

Formula: C6H8O3

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

IUPAC: methyl 2-methylidene-3-oxobutanoate

InChI: InChI=1S/C6H8O3/c1-4(5(2)7)6(8)9-3/h1H2,2-3H3

Composition: C (56.25%), H (6.29%), O (37.46%)

Molar Mass: 128.127

Atom Count: 17

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	128.047344118
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	OJSYSSUGQXWWRE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.69
Topological Polar Surface Area	43.37
Polarizability	12.43
Ring Count	0
Rotatable Bond Count	3

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