4-[[4-[Bis(2-chloroethyl)amino]phenyl]amino]-2,6-dimethylphenol

Modify Date: 2025-09-13 22:46:44

4-[[4-[Bis(2-chloroethyl)amino]phenyl]amino]-2,6-dimethylphenol Structure
4-[[4-[Bis(2-chloroethyl)amino]phenyl]amino]-2,6-dimethylphenol structure
Common Name 4-[[4-[Bis(2-chloroethyl)amino]phenyl]amino]-2,6-dimethylphenol
CAS Number 63979-56-6 Molecular Weight 353.28600
Density 1.26g/cm3 Boiling Point 491ºC at 760 mmHg
Molecular Formula C18H22Cl2N2O Melting Point N/A
MSDS N/A Flash Point 250.8ºC

 Names

Name 4-[4-[bis(2-chloroethyl)amino]anilino]-2,6-dimethylphenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.26g/cm3
Boiling Point 491ºC at 760 mmHg
Molecular Formula C18H22Cl2N2O
Molecular Weight 353.28600
Flash Point 250.8ºC
Exact Mass 352.11100
PSA 35.50000
LogP 5.10960
Index of Refraction 1.635
InChIKey OYZRSIFCXNQYLX-UHFFFAOYSA-N
SMILES Cc1cc(Nc2ccc(N(CCCl)CCCl)cc2)cc(C)c1O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
JJ8225000
CHEMICAL NAME :
Diphenylamine, 4-(bis(2-chloroethyl)amino)-4-hydroxy-3,5-dimethyl-
CAS REGISTRY NUMBER :
63979-56-6
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H22-Cl2-N2-O
MOLECULAR WEIGHT :
353.32
WISWESSER LINE NOTATION :
QR B1 F1 DMR DN2G2G

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 :
128 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 13,969,1964

 Synonyms

DIPHENYLAMINE,4-(BIS(2-CHLOROETHYL)AMINO)-4-HYDROXY-3,5-DIMETHYL
4'-(Di-2''-chloroethylamino)-4-hydroxy-3,5-dimethyldiphenylamine
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