2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone

Modify Date: 2025-09-22 12:33:28

2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone Structure
2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone structure
Common Name 2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone
CAS Number 42018-32-6 Molecular Weight 247.29000
Density 1.172g/cm3 Boiling Point 457.3ºC at 760 mmHg
Molecular Formula C14H17NO3 Melting Point N/A
MSDS USA Flash Point 230.4ºC

 Names

Name 2-(4-acetylphenoxy)-1-pyrrolidin-1-ylethanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.172g/cm3
Boiling Point 457.3ºC at 760 mmHg
Molecular Formula C14H17NO3
Molecular Weight 247.29000
Flash Point 230.4ºC
Exact Mass 247.12100
PSA 46.61000
LogP 1.82830
Index of Refraction 1.552
InChIKey GGYYBRCVBOHZBD-UHFFFAOYSA-N
SMILES CC(=O)c1ccc(OCC(=O)N2CCCC2)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM9817000
CHEMICAL NAME :
Acetophenone, 4'-pyrrolidinylcarbonylmethoxy-
CAS REGISTRY NUMBER :
42018-32-6
LAST UPDATED :
199007
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H17-N-O3
MOLECULAR WEIGHT :
247.32
WISWESSER LINE NOTATION :
T5NTJ AV1OR DV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CHTPBA Chimica Therapeutica. (Paris, France) V.1-8, 1965-73. For publisher information, see EJMCA5. Volume(issue)/page/year: 8,574,1973

 Safety Information

RIDADR NONH for all modes of transport
HS Code 2933990090

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4'-Pyrrolidinylcarbonylmethoxyacetophenone
ACETOPHENONE,4'-PYRROLIDINYLCARBONYLMETHOXY
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