N1,N2-Dimesitylethane-1,2-diamine

C₂₀H₂₈N₂CAS 134030-21-0296.46 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₂₀H₂₈N₂
Molar mass: 296.46 g/mol
Exact mass: 296.2252 Da
logP: 5.06Crippen estimate
Polar surface area: 24.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 5

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

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

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

134030-21-0

SMILES

CC1=CC(=C(C(=C1)C)NCCNC2=C(C=C(C=C2C)C)C)C

InChIKey

RQXQQXIIAQTDHU-UHFFFAOYSA-N

InChI

InChI=1S/C20H28N2/c1-13-9-15(3)19(16(4)10-13)21-7-8-22-20-17(5)11-14(2)12-18(20)6/h9-12,21-22H,7-8H2,1-6H3

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Names and synonyms

1 names

N,N'-Bis(2,4,6-trimethylphenyl)ethylenediamine

Work with N1,N2-Dimesitylethane-1,2-diamine

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

1,3,5-Trimethyl-2-((2,4,6-trimethylphenyl)methyl)benzene733-07-350 % similar Isodurene527-53-748 % similar Iodomesitylene4028-63-146 % similar 2,4,6-Trimethylbenzyl chloride1585-16-644 % similar 2,4,6-Trimethylbenzenemethanethiol21411-42-744 % similar 2,4,6-Trimethylbenzyl alcohol4170-90-544 % similar 2,4,6-Trimethylthiophenol1541-10-244 % similar 2-Chloromesitylene1667-04-544 % similar

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

Elsewhere

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