CAS 66357-59-3 Zantac (HCID 47909)

Overview

See also: Ranitidine Hydrochloride (annotation moved to).

Names & identifiers

Preferred name: Zantac
IUPAC: 1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine;hydrochloride
English name: Ranitidine Hydrochloride
Molecular formula: C13H22N4O3S.ClH
Molecular weight: 350.87

Names & synonyms

ZANTACRefChem:934486SantanolTanidinaToriolRadin71130-06-8RaniberlranicDigestosanServiradineAlvidina

Show more names

noctoneRanitidine HydrochloorideRANITIDINEHYDROCHLORIDE,USPRanitidine hydrochloride CRSZamecMelfaxZintacah19065

ArtomilAzuranitMideranNoktomeQuadrinRanibertaRanicuxRanidil

Database identifiers

CAS: 66357-59-3、71130-06-8
PubChem CID: 47909
DTXSID: DTXSID201015892
UNII: BK76465IHM
EC Number: 275-207-4

Properties

Computed structural properties

Topological polar surface area: 112 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 7
Rotatable bonds: 9
Heavy atoms: 22
Formal charge: 0
Complexity: 347

Physicochemical properties

Melting point: 134 °C · 134°C (dec.)
storage temp.: 2 · 2-8°C
solubility: 2 O: · H2O: 1.8 mg/mL
form: solid
pka: 8.27 · 8.27 (pKa2)
color: tan
Water Solubility: 2 · Soluble in water, 2-hydroxypropyl-beta-cyclodextrin, acetic acid, methanol, ethanol and dimethyl sulfoxide. Insoluble in chloroform.
Sensitive: Hygroscopic
Merck: 14 · 14,8110
BCS Class: 3 · 3/1
Stability: Hygroscopic
Major Application: pharmaceutical (small molecule)
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/b13-9+;
InChIKey: GGWBHVILAJZWKJ-KJEVSKRMSA-N
SMILES: C(/NC)(\NCCSCC1OC(CN(C)C)=CC=1)=C/[N+]([O-])=O.[H]Cl
CAS DataBase Reference: 66357 · 66357-59-3(CAS DataBase Reference)
FDA UNII: 76465 IHM · BK76465IHM
NCI Drug Dictionary: Zantac
UNSPSC Code: 41116107 · 41116107
NACRES: 77 · NA.77
Symbol(GHS): 7 · GHS07,GHS08
Signal word: Danger
Hazard statements: 315 · H315-H317-H319-H334-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
Hazard Codes: F,T
Risk Statements: 20 · 20/21/22-39/23/24/25-23/24/25-11
Safety Statements: 22 · 22-24/25-45-36/37-16-7
WGK Germany: 2 · 2
RTECS: 6557000 · KM6557000
HS Code: 2932190002 · 2932190002
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Resp · Eye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 54 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk: 2
rtecs: KM6557000
hs_code: 2932190002
risk_code: 20/21/22-39/23/24/25-23/24/25-11
Signal word: Danger
Symbol(GHS): GHS07,GHS08
hazard_code: F,T
safety_code: 22-24/25-45-36/37-16-7
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H317-H319-H334-H335
Hazard Classifications: Eye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 2 items

Various agents with different action mechanisms used to treat or ameliorate PEPTIC ULCER or irritation of the gastrointestinal tract. This has included ANTIBIOTICS to treat HELICOBACTER INFECTIONS; HISTAMINE H2 ANTAGONISTS to reduce GASTRIC ACID secretion; and ANTACIDS for symptomatic relief.

Drugs that selectively bind to but do not activate histamine H2 receptors, thereby blocking the actions of histamine. Their clinically most important action is the inhibition of acid secretion in the treatment of gastrointestinal ulcers. Smooth muscle may also be affected. Some drugs in this class have strong effects in the central nervous system, but these actions are not well understood.

Applications · 3 items

UsesA histamine H2-receptor antagonist which inhibits gastric acid secretion. Antiulcerative.

Usesantifungal

UsesAn H-2 histamine receptor antagonistRanitidine hydrochloride is mainly used as an H2-receptor antagonist and helps in the treatment of gastrointestinal lesions because of excessive gastric acid secretion. It also serves as an antiulcer drug.