N,N-Dimethyl-m-phenylenediamine dihydrochloride

C₈H₁₄Cl₂N₂CAS 3575-32-4209.11 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₈H₁₄Cl₂N₂
Molar mass: 209.11 g/mol
Exact mass: 208.0534 Da
logP: 2.18Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowed100% of notifiers
H311 Toxic in contact with skin13.3% of notifiers
H315 Causes skin irritation100% of notifiers
H317 May cause an allergic skin reaction86.7% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P262, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P333+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

3575-32-4

SMILES

CN(C)c1cccc(N)c1.Cl.Cl

InChIKey

BZJPIQKDEGXVFG-UHFFFAOYSA-N

InChI

InChI=1S/C8H12N2.2ClH/c1-10(2)8-5-3-4-7(9)6-8;;/h3-6H,9H2,1-2H3;2*1H

Weigh it out

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

Names and synonyms

7 names

1,3-Benzenediamine, N1,N1-dimethyl-, hydrochloride (1:2)
m-Phenylenediamine, N,N-dimethyl-, dihydrochloride
1,3-Benzenediamine, N,N-dimethyl-, dihydrochloride
N,N-Dimethyl-1,3-benzenediamine dihydrochloride
N,N-Dimethyl-1,3-phenylenediamine dihydrochloride
3-Dimethylaminoaniline dihydrochloride
N1,N1-Dimethyl-1,3-phenylenediamine dihydrochloride

Work with N,N-Dimethyl-m-phenylenediamine dihydrochloride

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

p-Amino-N,N-dimethylaniline monohydrochloride2052-46-259 % similar m-Phenylenediamine hydrochloride541-69-558 % similar 3-Chloroaniline hydrochloride141-85-553 % similar 3-(Dimethylamino)phenylboronic acid hydrochloride (contains varying amounts of anhydride)1256355-23-351 % similar 3-Chloro-N,N-dimethylbenzenamine6848-13-150 % similar Dimethyl-m-toluidine121-72-248 % similar Dimethyl-4-phenylenediamine99-98-948 % similar Tetramethyl-p-phenylenediamine dihydrochloride637-01-448 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N,N-Dimethyl-p-phenylenediamine dihydrochloride536-46-9 Betahistine dihydrochloride5579-84-0

Elsewhere

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