3-(ethoxymethylidene)pentane-2,4-dione

3-(ethoxymethylidene)pentane-2,4-dione

CAS: 33884-41-2

Formula: C8H12O3

SMILES: CCOC=C(C(C)=O)C(C)=O

IUPAC: 3-(ethoxymethylidene)pentane-2,4-dione

InChI: InChI=1S/C8H12O3/c1-4-11-5-8(6(2)9)7(3)10/h5H,4H2,1-3H3

Composition: C (61.52%), H (7.74%), O (30.73%)

Molar Mass: 156.181

Atom Count: 23

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	156.078644246
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ITTXGKOHFZJUEX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.95
Topological Polar Surface Area	43.37
Polarizability	16.08
Ring Count	0
Rotatable Bond Count	4

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