9,10-Dibutoxyanthracene

C₂₂H₂₆O₂CAS 76275-14-4322.45 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₂H₂₆O₂
Molar mass: 322.45 g/mol
Exact mass: 322.1933 Da
logP: 6.35Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 8

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

76275-14-4

SMILES

CCCCOC1=C2C=CC=CC2=C(C3=CC=CC=C31)OCCCC

InChIKey

KSMGAOMUPSQGTB-UHFFFAOYSA-N

InChI

InChI=1S/C22H26O2/c1-3-5-15-23-21-17-11-7-9-13-19(17)22(24-16-6-4-2)20-14-10-8-12-18(20)21/h7-14H,3-6,15-16H2,1-2H3

Weigh it out

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Work with 9,10-Dibutoxyanthracene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Butyl phenyl ether1126-79-061 % similar Dibutyl squarate2892-62-852 % similar 2-Butoxypyridine27361-16-652 % similar 2-Butoxyphenylboronic acid91129-69-047 % similar Benzyl butyl ether588-67-047 % similar 4-Butoxybenzonitrile5203-14-546 % similar 4-Butoxyphenol122-94-145 % similar 4-Butoxybromobenzene39969-57-845 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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