BUTYL-3-((DIMETHYLAMINO)METHYL)-4-HYDROXYBENZOATE

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Names

[ CAS No. ]:
6279-54-5

[ Name ]:
BUTYL-3-((DIMETHYLAMINO)METHYL)-4-HYDROXYBENZOATE

[Synonym ]:
Butyl 3-((dimethylamino)methyl)-4-hydroxybenzoate
BENZOIC ACID,3-((DIMETHYLAMINO)METHYL)-4-HYDROXY,BUTYL ESTER

Chemical & Physical Properties

[ Density]:
1.083g/cm3

[ Boiling Point ]:
359.3ºC at 760 mmHg

[ Molecular Formula ]:
C14H21NO3

[ Molecular Weight ]:
251.32100

[ Flash Point ]:
171.1ºC

[ Exact Mass ]:
251.15200

[ PSA ]:
49.77000

[ LogP ]:
2.41070

[ Index of Refraction ]:
1.53

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG8956000
CHEMICAL NAME :
Benzoic acid, 3-((dimethylamino)methyl)-4-hydroxy, butyl ester
CAS REGISTRY NUMBER :
6279-54-5
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C14-H21-N-O3
MOLECULAR WEIGHT :
251.36
WISWESSER LINE NOTATION :
4OVR DQ C1N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2 gm/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 11,85,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
475 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 11,85,1961

Related Compounds

  • butyl 3-methyl-4-phenylthiopent-2-enoate
  • butyl 3-methyl-4-phenylsulfanylpent-2-enoate
  • 5-[3-[(dimethylamino)methyl]-4-hydroxyphenyl]sulfonylthiophene-2-sulfonamide,hydrochloride
  • 1-[3-[(dimethylamino)methyl]-4-propoxyphenyl]-N,N-dimethylmethanamine
  • tert-butyl 3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate
  • tert-Butyl 3-methyl-4-oxopiperidine-1-carboxylate
  • Methyl 3-[(3-hydroxyazetidin-3-yl)methyl]thiophene-2-carboxylate
  • (1S)-1-(4-bromo-2,6-dimethoxyphenyl)ethan-1-amine
  • 1-(7-phenyl-3,4-dihydro-2H-1-benzopyran-3-yl)ethan-1-amine
  • 2-{1-[(Aminooxy)methyl]cyclopropyl}-4-chlorophenol
  • 4-{5-Chlorothieno[3,2-b]pyridin-2-yl}butanal
  • 1-(2-cyclobutylpropyl)-3-methyl-1H-pyrazol-4-amine
  • 3-cycloheptyl-4-fluoro-1-methyl-1H-pyrazol-5-amine
  • Tert-butyl 2-[1-(aminomethyl)-2,2-dimethylcyclopropyl]morpholine-4-carboxylate
  • Methyl 1-(3-hydroxy-1-methylpyrrolidin-3-yl)-3,3-dimethylcyclobutane-1-carboxylate
  • Methyl 3-(3-hydroxyazetidin-3-yl)-1-azabicyclo[2.2.2]octane-3-carboxylate
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