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Basic Information
CAS No.: 2441-88-5
Name: Benzenemethanol, a-[(2-pyrimidinylamino)methyl]-,hydrochloride (1:1)
Molecular Structure:
Molecular Structure of 2441-88-5 (Benzenemethanol, a-[(2-pyrimidinylamino)methyl]-,hydrochloride (1:1))
Formula: C12H13 N3 O . Cl H
Molecular Weight: 251.74
Synonyms: Benzenemethanol,a-[(2-pyrimidinylamino)methyl]-,monohydrochloride (9CI); Benzyl alcohol, a-[(2-pyrimidinylamino)methyl]-, hydrochloride (7CI);Benzyl alcohol, a-[(2-pyrimidinylamino)methyl]-,monohydrochloride (8CI); 2-[(b-Hydroxyphenethyl)amino]pyrimidine hydrochloride; Fenyripol hydrochloride;IN 836; NSC 43183; a-(2-Pyrimidinylaminomethyl)benzyl alcohol hydrochloride
Density: 1.26g/cm3
Boiling Point: 429.7°Cat760mmHg
Flash Point: 213.7°C
Safety: Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and HCl.
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Chemistry

Product Name: Fenyripol hydrochloride (CAS NO.2441-88-5)


Molecular Formula: C12H13N3O•ClH
Molecular Weight: 251.74g/mol
Mol File: 2441-88-5.mol
Boiling point: 429.7°C at 760mmHg
Flash Point: 213.7°C
Density: 1.26g/cm3
H-Bond Donor: 3
H-Bond Acceptor: 4
Structure Descriptors of Fenyripol hydrochloride (CAS NO.2441-88-5):
  IUPAC Name: 1-phenyl-2-(pyrimidin-2-ylamino)ethanol hydrochloride
  Canonical SMILES: C1=CC=C(C=C1)C(CNC2=NC=CC=N2)O.Cl
  InChI: InChI=1S/C12H13N3O.ClH/c16-11(10-5-2-1-3-6-10)9-15-12-13-7-4-8-14-12;/h1-8,11,16H,9H2,(H,13,14,15);1H 
  InChIKey: MEDWIGMHHZRIOP-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 125mg/kg (125mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Archives Internationales de Pharmacodynamie et de Therapie. Vol. 141, Pg. 83, 1963.
mouse LD50 intraperitoneal 360mg/kg (360mg/kg) BEHAVIORAL: COMA

CARDIAC: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES		 Anesthesie, Analgesie, Reanimation. Vol. 22, Pg. 87, 1965.
mouse LD50 intravenous 125mg/kg (125mg/kg) BEHAVIORAL: COMA

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

CARDIAC: OTHER CHANGES		 Anesthesie, Analgesie, Reanimation. Vol. 22, Pg. 87, 1965.
mouse LD50 oral 850mg/kg (850mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Archives Internationales de Pharmacodynamie et de Therapie. Vol. 141, Pg. 83, 1963.
rabbit LDLo intravenous 350mg/kg (350mg/kg) CARDIAC: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES		 Anesthesie, Analgesie, Reanimation. Vol. 22, Pg. 87, 1965.
rat LD50 intraperitoneal 235mg/kg (235mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Archives Internationales de Pharmacodynamie et de Therapie. Vol. 141, Pg. 83, 1963.

Safety Profile

Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and HCl.

Specification

 Fenyripol hydrochloride , its CAS NO. is 2441-88-5, the synonyms are 2-(beta-Hydroxy-beta-phenethylamino)-pyrimidine
hydrochloride ; 2-(beta-Hydroxy-beta-phenyl-ethyl-amino)-pyrimidine chlorhydrate ; Benzenemethanol, alpha-((2-pyrimidinylamino)methyl)-, monohydrochloride ; Benzyl alcohol, alpha-(2-pyrimidinylaminomethyl)-, hydrochloride ; Fenyripol HCl ; IN 836 ; NSC 43183 ; UNII-R4I084C0NO ; alpha-((2-Pyrimidinylamino)methyl)benzyl alcohol hydrochloride ; alpha-((2-Pyrimidinylamino)methyl)benzyl alcohol monohydrochloride .