BENZYL ALCOHOL, alpha-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDE

Modify Date: 2025-11-10 13:42:33

BENZYL ALCOHOL, alpha-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDE Structure
BENZYL ALCOHOL, alpha-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDE structure
Common Name BENZYL ALCOHOL, alpha-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDE
CAS Number 5331-85-1 Molecular Weight 307.81500
Density 1.102g/cm3 Boiling Point 413.1ºC at 760 mmHg
Molecular Formula C17H22ClNO2 Melting Point N/A
MSDS N/A Flash Point 203.6ºC

 Names

Name (3-hydroxy-2-phenoxy-3-phenylpropyl)-dimethylazanium,chloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.102g/cm3
Boiling Point 413.1ºC at 760 mmHg
Molecular Formula C17H22ClNO2
Molecular Weight 307.81500
Flash Point 203.6ºC
Exact Mass 307.13400
PSA 32.70000
LogP 3.53120
Index of Refraction 1.573
InChIKey AAPGKZFKHTZMTB-UHFFFAOYSA-N
SMILES C[NH+](C)CC(Oc1ccccc1)C(O)c1ccccc1.[Cl-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DO5430000
CHEMICAL NAME :
Benzyl alcohol, alpha-(2-(dimethylamino)-1-phenoxyethyl)-, hydrochloride
CAS REGISTRY NUMBER :
5331-85-1
LAST UPDATED :
198509
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H21-N-O2.Cl-H
MOLECULAR WEIGHT :
307.85
WISWESSER LINE NOTATION :
QYR&YOR&1N1&1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
118 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962

 Safety Information

HS Code 2922509090

 Precursor & DownStream

Precursor  1

DownStream  0

 Customs

HS Code 2922509090
Summary 2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

3-dimethylamino-2-phenoxy-1-phenyl-propan-1-ol,hydrochloride
3-hydroxy-N,N-dimethyl-2-phenoxy-3-phenylpropan-1-aminium chloride
U-0177
(3-hydroxy-2-phenoxy-3-phenylpropyl)-dimethylazanium chloride
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