4-(2-methylimidazol-1-yl)butanoic acid

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Names

[ CAS No. ]:
110525-54-7

[ Name ]:
4-(2-methylimidazol-1-yl)butanoic acid

[Synonym ]:
2-Methylimidazole-1-butyric acid
2-Methyl-1H-imidazole-1-butanoic acid
Imidazole-1-butyric acid,2-methyl
1H-Imidazole-1-butanoic acid,2-methyl

Chemical & Physical Properties

[ Density]:
1.18g/cm3

[ Boiling Point ]:
394.9ºC at 760mmHg

[ Molecular Formula ]:
C8H12N2O2

[ Molecular Weight ]:
168.19300

[ Flash Point ]:
192.6ºC

[ Exact Mass ]:
168.09000

[ PSA ]:
55.12000

[ LogP ]:
1.05630

[ Vapour Pressure ]:
6.06E-07mmHg at 25°C

[ Index of Refraction ]:
1.552

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI3889000
CHEMICAL NAME :
Imidazole-1-butyric acid, 2-methyl-
CAS REGISTRY NUMBER :
110525-54-7
LAST UPDATED :
199312
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H12-N2-O2
MOLECULAR WEIGHT :
168.22
WISWESSER LINE NOTATION :
T5N CN AHJ A3VQ B1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
600 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: 42,425,1987

Safety Information

[ Hazard Codes ]:
Xi: Irritant;

[ HS Code ]:
2933290090

Customs

[ HS Code ]: 2933290090

[ Summary ]:
2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 4-(2-METHYLIMIDAZOL-1-YL)BUTYRIC ACID ETHYL ESTER
  • 3-(2-methylimidazol-1-yl)butanoic acid
  • 4-(2-methylimidazol-1-yl)benzoic acid,hydrochloride
  • 4-(2-cyanopyrrol-1-yl)butanoic acid
  • 4-(2-formylpyrrol-1-yl)butanoic acid
  • 4-(2-oxopiperidin-1-yl)butanoic acid
  • 7-Bromo-benzo[d]isothiazol-5-ylamine
  • tert-butyl 6(S)-((4-nitrobenzoyloxy)methyl)-5-azaspiro[2.4]heptane-5-carboxylate
  • tert-butyl 2(S)-((4-nitrobenzoyloxy)methyl)-4-oxopyrrolidine-1-carboxylate
  • 4-oxo-1-(tert-butoxycarbonyl)piperidine-2(S)-carboxylic acid benzyl ester
  • (+/-)Tert-butyl 7-(((6-methylpyridin-2-yl)amino)methyl)-8-azaspiro[4.5]decane-8-carboxylate
  • tert-butyl 4-methylene-2(S)-((4-nitrobenzoyloxy)methyl)pyrrolidine-1-carboxylate
  • tert-butyl 6(S)-((1,3-dioxoisoindolin-2-yl)methyl)-5-azaspiro[2.4]heptane-5-carboxylate
  • N-(5-chloro-2-pyridinyl)-8-azaspiro[4.5]decane-7-methanamine
  • 2-[(6-azaspiro[2.5]oct-5-ylmethyl)amino]-5-chloroBenzoic acid methyl ester
  • tert-butyl (2S)-2-(hydroxymethyl)-4-methyl-pyrrolidine-1-carboxylate
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