3-Chloro-2,6-diethylaniline

C₁₀H₁₄ClNCAS 67330-62-5183.68 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₁₀H₁₄ClN
Molar mass: 183.68 g/mol
Exact mass: 183.0815 Da
logP: 3.05Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

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

67330-62-5

SMILES

CCC1=C(C(=C(C=C1)Cl)CC)N

InChIKey

VDJBIPLKIGSVRG-UHFFFAOYSA-N

InChI

InChI=1S/C10H14ClN/c1-3-7-5-6-9(11)8(4-2)10(7)12/h5-6H,3-4,12H2,1-2H3

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Work with 3-Chloro-2,6-diethylaniline

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

2,6-Diethylaniline579-66-854 % similar 4,4'-Methylenebis(3-chloro-2,6-diethylaniline)106246-33-751 % similar 2-Ethyl-6-methylaniline24549-06-245 % similar 1-Chloro-2-ethylbenzene89-96-345 % similar 4-Chloro-3-ethylphenol14143-32-943 % similar 4,4′-Methylenebis[2,6-diethylaniline]13680-35-839 % similar 2,6-Diethyl-4-methylbenzenamine24544-08-939 % similar 4-Bromo-2,6-diethylaniline56746-19-138 % similar

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

Same formula

1,2,3,4-Tetrahydro-1-naphthylamine hydrochloride49800-23-9 (R)-3-Phenyl-pyrrolidine hydrochloride851000-46-9 3-Phenyl-pyrrolidine hydrochloride857281-02-8 N-Ethyl-N-(2-chloroethyl)aniline92-49-9

Elsewhere

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