Chlorpheniramine maleate

C₂₀H₂₃ClN₂O₄CAS 113-92-8390.86 g/mol

Open in Covalent MOL file

Alkene Aryl halide Carboxylic acid Tertiary amine

Properties

Molecular formula: C₂₀H₂₃ClN₂O₄
Molar mass: 390.86 g/mol
Exact mass: 390.1346 Da
Melting point: 130–135 °C
Water solubility: 10–50 g/L (21.1 °C)
logP: 3.53Crippen estimate
Polar surface area: 90.7 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 7

Hazards

Danger

H301 Toxic if swallowed87.6% of notifiers
H302 Harmful if swallowed11.2% of notifiers
H311 Toxic in contact with skin32.8% of notifiers
H314 Causes severe skin burns and eye damage14.9% of notifiers
H318 Causes serious eye damage15.8% of notifiers
H336 May cause drowsiness or dizziness16.2% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure15.4% of notifiers

Aggregated from 241 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P361+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

113-92-8

SMILES

CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1.O=C(O)/C=CC(=O)O

InChIKey

DBAKFASWICGISY-BTJKTKAUSA-N

InChI

InChI=1S/C16H19ClN2.C4H4O4/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-9,11,15H,10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

Weigh it out

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

Names and synonyms

39 names · show all

2-Pyridinepropanamine, γ-(4-chlorophenyl)-N,N-dimethyl-, (2Z)-2-butenedioate (1:1)
Pyridine, 2-[p-chloro-α-[2-(dimethylamino)ethyl]benzyl]-, maleate (1:1)
2-Pyridinepropanamine, γ-(4-chlorophenyl)-N,N-dimethyl-, (Z)-2-butenedioate (1:1)
1-p-Chlorophenyl-1-(2-pyridyl)-3-dimethylaminopropane maleate
Histadur dura-tabs
Ibioton
1-Parachlorophenyl-1-(2-pyridyl)-3-dimethylaminopropane maleate
Piriex
Synistamin
Teldrin
Piriton
Chlor-trimeton
Chloroprophenpyridamine maleate
Chlor-tripolon
Chlorprophenpyridamine maleate
Carbinoxamide maleate
Neorestamin
Allergin
Chlorphenamine maleate
Puermin
Dl-Chlorpheniramine maleate
(±)-Chlorpheniramine maleate
Chlorophenamine
Cloropiril
Allergisan
Histaspan
Antagonate
C-Meton
Chlorphenamine hydrogen maleate
Pyridamal 100
Histadur
Lorphen
Pirafene
Anallerge 4
Calimal
Niramine
Iramine
Histamil
Chlorphenamine

Work with Chlorpheniramine maleate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

(±)-Pheniramine86-21-559 % similar (±)-Brompheniramine86-22-656 % similar Bepotastine125602-71-346 % similar 2-[(S)-(4-Chlorophenyl)(4-piperidinyloxy)methyl]pyridine (2R,3R)-2,3-dihydroxybutanedioate210095-58-242 % similar (S)-(4-Chlorophenyl)(pyridin-2-yl)methanol176022-47-242 % similar α-(4-Chlorophenyl)-2-pyridinemethanol27652-89-742 % similar 2-(4,Alpha-dichlorobenzyl)pyridine142404-69-140 % similar 2-((4-Chlorophenyl)(4-piperidinyloxy)methyl)pyridine122368-54-140 % similar

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

Elsewhere

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