doxylamine

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Names

[ CAS No. ]:
469-21-6

[ Name ]:
doxylamine

[Synonym ]:
Dossilamina
N,N-Dimethyl-2-[(1R)-1-phenyl-1-(2-pyridinyl)ethoxy]ethanamine
Doxylaminum
doxilamina
Ethanamine, N,N-dimethyl-2-[(1R)-1-phenyl-1-(2-pyridinyl)ethoxy]-
N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
Doxilminio

Chemical & Physical Properties

[ Density]:
1.043 g/cm3

[ Boiling Point ]:
364.9ºC at 760 mmHg

[ Melting Point ]:
25°C

[ Molecular Formula ]:
C17H22N2O

[ Molecular Weight ]:
270.37

[ Flash Point ]:
174.5ºC

[ Exact Mass ]:
270.17300

[ PSA ]:
25.36000

[ LogP ]:
2.92330

[ Index of Refraction ]:
1.5486 (estimate)

[ Storage condition ]:
-20°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
US9250000
CHEMICAL NAME :
Pyridine, 2-(alpha-(2-(dimethylamino)ethoxy)-alpha-methylbenzyl )-
CAS REGISTRY NUMBER :
469-21-6
BEILSTEIN REFERENCE NO. :
0230379
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C17-H22-N2-O
MOLECULAR WEIGHT :
270.41
WISWESSER LINE NOTATION :
T6NJ BX1&R&O2N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
440 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(5),17,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
470 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(5),17,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
460 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(5),17,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
62 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(5),17,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - rigidity (including catalepsy)
REFERENCE :
DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(5),17,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
49 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - rigidity (including catalepsy)
REFERENCE :
DPIRDU Dangerous Properties of Industrial Materials Report. (Van Nostrand Reinhold, 115 Fifth Ave., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 2(5),17,1982

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • Doxylamine-d5
  • Doxylamine N-Oxide
  • Doxylamine N-oxide
  • DOXYLAMINE SUCCINATE
  • Desmethyl Doxylamine
  • Doxylamine di-N-Oxide
  • 2-{[(benzyloxy)carbonyl]amino}-3-{1H-pyrrolo[3,2-b]pyridin-3-yl}propanoic acid
  • (1S)-2-amino-1-(1-ethyl-1H-1,2,4-triazol-5-yl)ethan-1-ol
  • 3-{[(Tert-butoxy)carbonyl]amino}-4-hydroxyoxane-4-carboxylic acid
  • Benzyl 8-(aminomethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-4-carboxylate
  • Benzyl 9-amino-2,3,4,5-tetrahydro-1,4-benzoxazepine-4-carboxylate
  • 4-[(Tert-butoxy)carbonyl]-3,4-dihydrospiro[1,4-benzoxazine-2,1'-cyclopropane]-7-carboxylic acid
  • 6-bromo-2-ethyl-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid
  • 7-bromo-2-methyl-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid
  • 2-[(1s,3r)-1-(5-Bromo-2-methylphenyl)-3-fluorocyclobutyl]acetic acid
  • 5-(4-Formylpyridin-2-yl)furan-2-carboxylic acid
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