1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
Names
[ CAS No. ]:
116834-08-3
[ Name ]:
1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
[Synonym ]:
1-phenyl-5-pyrrolylpyrazole-4-carboxylic acid
1H-Pyrazole-4-carboxylicacid,1-phenyl-5-(1H-pyrrol-1-yl)
1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
1-phenyl-5-pyrrol-1-yl-1H-pyrazole-4-carboxylic acid
Chemical & Physical Properties
[ Density]:
1.3g/cm3
[ Boiling Point ]:
468.8ºC at 760mmHg
[ Melting Point ]:
185-189ºC
[ Molecular Formula ]:
C14H11N3O2
[ Molecular Weight ]:
253.25600
[ Flash Point ]:
237.3ºC
[ Exact Mass ]:
253.08500
[ PSA ]:
60.05000
[ LogP ]:
2.36120
[ Vapour Pressure ]:
1.37E-09mmHg at 25°C
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UQ6437500
- CHEMICAL NAME :
- 1H-Pyrazole-4-carboxylic acid, 1-phenyl-5-(1H-pyrrol-1-yl)-
- CAS REGISTRY NUMBER :
- 116834-08-3
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C14-H11-N3-O2
- MOLECULAR WEIGHT :
- 253.28
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >200 mg/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: 43,251,1988
Safety Information
[ HS Code ]:
2933990090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
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%