1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone

Modify Date: 2025-09-18 12:14:13

1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone Structure
1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone structure
 Common Name 1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone
CAS Number 87049-09-0 Molecular Weight 382.49400
Density 1.098g/cm3 Boiling Point 553.4ºC at 760 mmHg
Molecular Formula C20H34N2O5 Melting Point N/A
MSDS N/A Flash Point 288.5ºC

 Names

Name 1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone

 Chemical & Physical Properties

Density 1.098g/cm3
Boiling Point 553.4ºC at 760 mmHg
Molecular Formula C20H34N2O5
Molecular Weight 382.49400
Flash Point 288.5ºC
Exact Mass 382.24700
PSA 100.05000
LogP 2.14640
Index of Refraction 1.521
InChIKey HJMRKJGQMNYYGB-UHFFFAOYSA-N
SMILES CC(=O)c1ccc(OCC(O)CNC(C)C)cc1OCC(O)CNC(C)C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5545650
CHEMICAL NAME :
Ethanone, 1-(2,4-bis(2-hydroxy-3-((1-methylethyl)amino)propoxy) phenyl)-
CAS REGISTRY NUMBER :
87049-09-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H34-N2-O5
MOLECULAR WEIGHT :
382.56

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
31600 ug/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 22,140,1983

 Synthetic Route

2,4-bis(2,3-epoxypropoxy)acetophenone structure

2,4-bis(2,3-epo...

CAS#:87048-90-6

isopropylamine structure

isopropylamine

CAS#:75-31-0

~89%

1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone Structure

1-[2,4-bis[2-hy...

CAS#:87049-09-0

Literature: Malik, Mangel S.; Rastogi, Shri Nivas; Srimal, R. C.; Kar, K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1983 , vol. 22, # 2 p. 140 - 145
2,4-Dihydroxyacetophenone structure

2,4-Dihydroxyac...

CAS#:89-84-9

~%

1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone Structure

1-[2,4-bis[2-hy...

CAS#:87049-09-0

Literature: Malik, Mangel S.; Rastogi, Shri Nivas; Srimal, R. C.; Kar, K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1983 , vol. 22, # 2 p. 140 - 145
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Chemsrc provides CAS#:87049-09-0 MSDS, density, melting point, boiling point, structure, etc. Its name is 1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone>> amp version: 1-[2,4-bis[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethanone

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