1-[4-amino-5-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrol-3-yl]ethanone

Modify Date: 2025-11-29 18:59:23

1-[4-amino-5-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrol-3-yl]ethanone Structure
1-[4-amino-5-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrol-3-yl]ethanone structure
Common Name 1-[4-amino-5-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrol-3-yl]ethanone
CAS Number 91480-90-9 Molecular Weight 274.31500
Density 1.186g/cm3 Boiling Point 454.7ºC at 760mmHg
Molecular Formula C15H18N2O3 Melting Point N/A
MSDS N/A Flash Point 228.8ºC

 Names

Name 1-[4-amino-5-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrol-3-yl]ethanone

 Chemical & Physical Properties

Density 1.186g/cm3
Boiling Point 454.7ºC at 760mmHg
Molecular Formula C15H18N2O3
Molecular Weight 274.31500
Flash Point 228.8ºC
Exact Mass 274.13200
PSA 77.34000
LogP 3.37330
Index of Refraction 1.587
InChIKey YOTCWOYQOGHXBT-UHFFFAOYSA-N
SMILES COc1ccc(-c2[nH]c(C)c(C(C)=O)c2N)cc1OC

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5507400
CHEMICAL NAME :
Ethanone, 1-(4-amino-5-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrol -3-yl)-
CAS REGISTRY NUMBER :
91480-90-9
LAST UPDATED :
199307
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H18-N2-O3
MOLECULAR WEIGHT :
274.35

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 :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 39,538,1984
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