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7-[4-(dimethylamino)phenyl]-4,6-dimethyl-7-oxohepta-2,4-dienoic acid

7-[4-(dimethylamino)phenyl]-4,6-dimethyl-7-oxohepta-2,4-dienoic acid

Formula: C17H21NO3

SMILES: CC(C=C(C)C=CC(O)=O)C(=O)C1=CC=C(C=C1)N(C)C

IUPAC: 7-[4-(dimethylamino)phenyl]-4,6-dimethyl-7-oxohepta-2,4-dienoic acid

InChI: InChI=1/C17H21NO3/c1-12(5-10-16(19)20)11-13(2)17(21)14-6-8-15(9-7-14)18(3)4/h5-11,13H,1-4H3,(H,19,20)

Composition: C (71.06%), H (7.37%), N (4.87%), O (16.70%)

Molar Mass: 287.359

Atom Count: 42

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 287.15214354
Formal Charge 0
FSP3 0.29
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VKEITMNFEJHFCX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.65
Topological Polar Surface Area 57.61
Polarizability 31.8
Ring Count 1
Rotatable Bond Count 6

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Purity (%)
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Days
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <14 Days C17H21NO3 Quote Only
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <14 Days C17H21NO3 Quote Only