Ranitidine hydrochloride

C₁₃H₂₃ClN₄O₃SCAS 66357-59-3350.86 g/mol

Open in Covalent MOL file

Alkene Nitro Secondary amine Sulfide Tertiary amine

Properties

Molecular formula: C₁₃H₂₃ClN₄O₃S
Molar mass: 350.86 g/mol
Exact mass: 350.1179 Da
Melting point: 133–134 °C
logP: 1.88Crippen estimate
Polar surface area: 83.6 Å²
H-bond donors / acceptors: 2 / 7
Rotatable bonds: 10

Hazards

Danger

H315 Causes skin irritation100% of notifiers
H317 May cause an allergic skin reaction100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled96.3% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 54 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, P501

Identifiers

CAS number

66357-59-3

SMILES

CNC(=C[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1.Cl

InChIKey

GGWBHVILAJZWKJ-UHFFFAOYSA-N

InChI

InChI=1S/C13H22N4O3S.ClH/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3;/h4-5,9,14-15H,6-8,10H2,1-3H3;1H

Weigh it out

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

Names and synonyms

90 names · show all

1,1-Ethenediamine, N-[2-[[[5-[(dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-N′-methyl-2-nitro-, hydrochloride (1:1)
1,1-Ethenediamine, N-[2-[[[5-[(dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-N′-methyl-2-nitro-, monohydrochloride
AH 19065
Zantac
Ranigast
Ranuber
Normon
Azantac
Ultac
Sostril
Raniogas
Urantac
Rantacid
Antagonin
Ranisen
Ranix
Ezopta
Ranacid
Radinat
Histac
Achedos
Xanidine
Axoban
Raticina
Ratic
Histak
Zinetac
Ranitiget
Ulcex
Ulceranin
Ulceran
Consec
Quicran
Raniplex
Anistal
Rosimol
Simetac
Lydin
Apozan
Rantac
Aciloc
Apo-ranitidine
Randin
Ptinolin
Eltidine
Gastrosedol
Raniben
Zantab
Zantadin
Galidrin
Vesyca
Microtid
Ranidil
Ulcirex
Coralen
Rani 2
Ranimex
Gastridin
Gastrial
Neoceptin R
Ranial
Aldin
Zantic
Atural
Weidos
Ranital
RND
Rantin
Acloral
Ranin
Vizerul
Ulsal
Ranidine
Ul-pep
Weichilin
Verlost
Acidex
Curan
Taural
Quantor
Trigger
Melfax
Terposen
Noctone
Ultidine
Ranitidine-akri
Rantidol
Ranitin
Zintac
Ranitab

Work with Ranitidine hydrochloride

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.

Ranitidine66357-35-5Free base 1,1-Ethenediamine, N-[2-[[[5-[(dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-N′-methyl-2-nitro-, hydrochloride (1:?)71130-06-8

Similar compounds

Nizatidine76963-41-261 % similar 5-(((2-Aminoethyl)thio)methyl)-N,N-dimethyl-2-furanmethanamine66356-53-443 % similar ((2-(Hydroxymethyl)-5-furyl)methyl)ammonium chloride81074-81-936 % similar N-[(6-Chloro-3-pyridinyl)methyl]-N-ethyl-N′-methyl-2-nitro-1,1-ethenediamine120738-89-832 % similar Nitenpyram150824-47-832 % similar N-Methyl-1-(methylthio)-2-nitroethenamine61832-41-530 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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