CAS 116834-08-3|1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID

Introduction：Basic information about CAS 116834-08-3|1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Synonyms

Common Name	1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
CAS Number	116834-08-3	Molecular Weight	253.25600
Density	1.3g/cm3	Boiling Point	468.8ºC at 760mmHg
Molecular Formula	C₁₄H₁₁N₃O₂	Melting Point	185-189ºC
MSDS	USA	Flash Point	237.3ºC

Names

Name	1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxylic acid
Synonym	More Synonyms

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
InChIKey	UOWVLCHBFVAAQI-UHFFFAOYSA-N
SMILES	O=C(O)c1cnn(-c2ccccc2)c1-n1cccc1

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

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

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

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