9,10-Bis(chloromethyl)anthracene

C₁₆H₁₂Cl₂CAS 10387-13-0275.17 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₆H₁₂Cl₂
Molar mass: 275.17 g/mol
Exact mass: 274.0316 Da
Melting point: 233–240 °C
logP: 5.47Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H413 May cause long lasting harmful effects to aquatic life97.5% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, P501

Identifiers

CAS number

10387-13-0

SMILES

ClCc1c2ccccc2c(CCl)c2ccccc12

InChIKey

UOSROERWQJTVNU-UHFFFAOYSA-N

InChI

InChI=1S/C16H12Cl2/c17-9-15-11-5-1-2-6-12(11)16(10-18)14-8-4-3-7-13(14)15/h1-8H,9-10H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

Anthracene, 9,10-bis(chloromethyl)-
9,10-Di(chloromethyl)anthracene
NSC 81650

Work with 9,10-Bis(chloromethyl)anthracene

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

9-(Chloromethyl)anthracene24463-19-268 % similar Benzyl chloride100-44-755 % similar 2,6-Dichlorobenzyl chloride2014-83-750 % similar α,α′-Dichloro-o-xylene612-12-450 % similar 1-(Chloromethyl)-2-methylnaphthalene6626-23-950 % similar 1-Chloromethylnaphthalene35255-58-448 % similar 1-(Chloromethyl)naphthalene86-52-248 % similar Alpha,alpha'-Dichloro-p-xylene623-25-647 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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