1,7-bis(3,4-dimethoxyphenyl)hepta-1,6-diene-3,5-dione

1,7-bis(3,4-dimethoxyphenyl)hepta-1,6-diene-3,5-dione

CAS: 52328-98-0

Formula: C23H24O6

SMILES: COC1=C(OC)C=C(C=CC(=O)CC(=O)C=CC2=CC(OC)=C(OC)C=C2)C=C1

IUPAC: 1,7-bis(3,4-dimethoxyphenyl)hepta-1,6-diene-3,5-dione

InChI: InChI=1S/C23H24O6/c1-26-20-11-7-16(13-22(20)28-3)5-9-18(24)15-19(25)10-6-17-8-12-21(27-2)23(14-17)29-4/h5-14H,15H2,1-4H3

Composition: C (69.68%), H (6.10%), O (24.21%)

Molar Mass: 396.439

Atom Count: 53

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	396.157288493
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	HMJSBVCDPKODEX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.78
Topological Polar Surface Area	71.06
Polarizability	42.54
Ring Count	2
Rotatable Bond Count	10

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