Xanthene

C₁₃H₁₀OCAS 92-83-1182.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₀O
Molar mass: 182.22 g/mol
Exact mass: 182.0732 Da
Melting point: 100.5 °C
Boiling point: 311 °C
logP: 3.38Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H317 May cause an allergic skin reaction100% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, P501

Identifiers

CAS number

92-83-1

SMILES

c1ccc2c(c1)Cc1ccccc1O2

InChIKey

GJCOSYZMQJWQCA-UHFFFAOYSA-N

InChI

InChI=1S/C13H10O/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2

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Names and synonyms

4 names

9H-Xanthene
10H-9-Oxaanthracene
9-Oxa-9,10-dihydroanthracene
NSC 46931

Work with Xanthene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Bicyclo(4.1.0)hepta-1,3,5-triene4646-69-956 % similar 9,10-Dihydroanthracene613-31-056 % similar Fluorene86-73-748 % similar Dihydrobenzofuran496-16-244 % similar 2-Phenoxyphenylacetonitrile25562-98-543 % similar 2-Methoxybenzyl chloride7035-02-143 % similar Phenoxazine135-67-142 % similar Phenoxathiin262-20-442 % similar

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

Same formula

Benzophenone119-61-9 [1,1′-Biphenyl]-2-carboxaldehyde1203-68-5 [1,1′-Biphenyl]-3-carboxaldehyde1204-60-0 Fluorenol1689-64-1 [1,1′-Biphenyl]-4-carboxaldehyde3218-36-8 Atractylodin55290-63-6

Elsewhere

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