4-(bis(2-chloroethyl)amino)phenol

Modify Date: 2023-01-26 17:39:46

4-(bis(2-chloroethyl)amino)phenol Structure
4-(bis(2-chloroethyl)amino)phenol structure
Common Name 4-(bis(2-chloroethyl)amino)phenol
CAS Number 2089-46-5 Molecular Weight 487.51500
Density 1.087g/cm3 Boiling Point 508.8ºC at 760 mmHg
Molecular Formula C27H39BrN2O Melting Point N/A
MSDS N/A Flash Point 223.8ºC

 Names

Name 4-(bis(2-chloroethyl)amino)phenol

 Chemical & Physical Properties

Density 1.087g/cm3
Boiling Point 508.8ºC at 760 mmHg
Molecular Formula C27H39BrN2O
Molecular Weight 487.51500
Flash Point 223.8ºC
Exact Mass 486.22500
PSA 26.71000
LogP 6.52380
Vapour Pressure 5.67E-11mmHg at 25°C
Index of Refraction 1.585

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SJ7800000
CHEMICAL NAME :
Phenol, 2,6-bis(piperidinomethyl)-4-(alpha,alpha-dimethylbenz yl)-, dihydrobromide
CAS REGISTRY NUMBER :
2089-46-5
LAST UPDATED :
199009
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C27-H38-N2-O.2Br-H
MOLECULAR WEIGHT :
568.51
WISWESSER LINE NOTATION :
T6NTJ A1R BQ EX1&1&R& C1- AT6NTJ &EH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
17 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 8,167,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
330 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: 132,295,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
15 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 8,167,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
30 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: 132,295,1961

 Safety Information

HS Code 2933399090

 Customs

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%