4,4′-Dimethoxytrityl chloride

C₂₁H₁₉ClO₂CAS 40615-36-9338.83 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₂₁H₁₉ClO₂
Molar mass: 338.83 g/mol
Exact mass: 338.1074 Da
logP: 5.23Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 5

Hazards

Danger

H314 Causes severe skin burns and eye damage44.4% of notifiers
H315 Causes skin irritation55.6% of notifiers
H317 May cause an allergic skin reaction44.4% of notifiers
H318 Causes serious eye damage44.4% of notifiers
H319 Causes serious eye irritation55.6% of notifiers
H335 May cause respiratory irritation83.3% of notifiers
H411 Toxic to aquatic life with long lasting effects44.4% of notifiers

Aggregated from 18 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P271, P272, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, P501

Identifiers

CAS number

40615-36-9

SMILES

COc1ccc(C(Cl)(c2ccccc2)c2ccc(OC)cc2)cc1

InChIKey

JBWYRBLDOOOJEU-UHFFFAOYSA-N

InChI

InChI=1S/C21H19ClO2/c1-23-19-12-8-17(9-13-19)21(22,16-6-4-3-5-7-16)18-10-14-20(24-2)15-11-18/h3-15H,1-2H3

Weigh it out

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

Names and synonyms

10 names

Benzene, 1,1′-(chlorophenylmethylene)bis[4-methoxy-
1,1′-(Chlorophenylmethylene)bis[4-methoxybenzene]
4,4′-Dimethoxytriphenylmethyl chloride
Chlorobis(4-methoxyphenyl)phenylmethane
Bis(4-methoxyphenyl)phenylmethyl chloride
NSC 89782
1-[(Chloro)(4-methoxyphenyl)(phenyl)methyl]-4-methoxybenzene
DMTrCl
1-[Chloro(4-methoxyphenyl)benzyl]-4-methoxybenzene
1,1'-(Chlorophenylmethylene)bis(4-methoxybenzene)

Work with 4,4′-Dimethoxytrityl chloride

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

4-Methoxytrityl chloride14470-28-1100 % similar Triphenylmethyl chloride76-83-560 % similar 4-Methyltrityl chloride23429-44-957 % similar Anisole100-66-354 % similar 4-Methoxybiphenyl613-37-652 % similar 4-Methoxy-N-(4-methoxyphenyl)-N-phenylaniline20440-94-252 % similar 4-tert-Butylanisole5396-38-350 % similar 1-Methoxy-4-(trifluoromethyl)benzene402-52-848 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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