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4-(2-Furanyl)-4-(tert-butyldimethylsiloxy)-1-butene structure

4-(2-Furanyl)-4-(tert-butyldimethylsiloxy)-1-butene structure

4-(2-Furanyl)-4-(tert-butyldimethylsiloxy)-1-butene

Iupac Name：sodium;2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate

CAS No.：67430-45-9

Molecular Weight：330.3

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1. Names and Identifiers

1.1 Name: 4-(2-Furanyl)-4-(tert-butyldimethylsiloxy)-1-butene
1.2 Synonyms: {[1-(2-Furyl)-3-buten-1-yl]oxy}(dimethyl)(2-methyl-2-propanyl)silane Silane, (1,1-dimethylethyl)[[1-(2-furanyl)-3-buten-1-yl]oxy]dimethyl-

1.3 CAS No.: 67430-45-9

1.4 CID: 16204922

1.5 Molecular Formula: C₉H₁₆ClNO₂ (isomer)

1.6 Inchi: InChI=1S/C19H16O4.Na/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;/h2-10,15,21H,11H2,1H3;/q;+1/p-1

1.7 InChkey: KYITYFHKDODNCQ-UHFFFAOYSA-M

1.8 Canonical Smiles: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]

1.9 Isomers Smiles: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]

2. Computational chemical data

Molecular Weight：330.3g/mol
Molecular Formula：C_₉H_₁₆ClNO_₂
Compound Is Canonicalized：True
XLogP3-AA：
Exact Mass：330.08680324
Monoisotopic Mass：330.08680324
Complexity：508
Rotatable Bond Count：4
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：4
Topological Polar Surface Area：66.4
Heavy Atom Count：24
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：1
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：2

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Directory

1. Names and Identifiers

1.5 Molecular Formula

1.8 Canonical Smiles

1.9 Isomers Smiles

2.Computational chemical data

3.Recommended Suppliers