Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 3-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
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Purity: 98.0%
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26180-28-9

26180-28-9 structure

26180-28-9 structure

Name: 3-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid
Chemical Name: 3-(2,5-Dimethylpyrrol-1-yl)benzoic acid
CAS Number: 26180-28-9
Molecular Formula: C₁₃H₁₃NO₂
Molecular Weight: 215.248
Create Date: 2018-12-30 02:38:52
Modify Date: 2024-04-02 17:34:35

Name	3-(2,5-Dimethylpyrrol-1-yl)benzoic acid
Synonyms	Benzoic acid, 3-(2,5-dimethyl-1H-pyrrol-1-yl)- 3-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid

Density	1.1±0.1 g/cm3
Boiling Point	401.9±33.0 °C at 760 mmHg
Molecular Formula	C₁₃H₁₃NO₂
Molecular Weight	215.248
Flash Point	196.9±25.4 °C
Exact Mass	215.094635
PSA	42.23000
LogP	3.68
Vapour Pressure	0.0±1.0 mmHg at 25°C
Index of Refraction	1.579

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DG9096716

CHEMICAL NAME :: Benzoic acid, m-(2,5-dimethylpyrrol-1-yl)-

CAS REGISTRY NUMBER :: 26180-28-9

LAST UPDATED :: 199803

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H13-N-O2

MOLECULAR WEIGHT :: 215.27

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 :: 1600 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: FRXXBL French Demande Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2054474

HS Code	2933990090

99-05-8 structure

99-05-8

110-13-4 structure

110-13-4

~96%

26180-28-9 structure

26180-28-9

Literature: Devi, Aarti; Shallu; Sharma; Singh, Jasvinder Synthetic Communications, 2012 , vol. 42, # 10 p. 1480 - 1488

Precursor 2
99-05-8 110-13-4
DownStream 0

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%