5-Chloro-2-methylbenzo[d]oxazole

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Names

[ CAS No. ]:
19219-99-9

[ Name ]:
5-Chloro-2-methylbenzo[d]oxazole

[Synonym ]:
5-chloro-2-methyl-benzooxazole
5-Chloro-2-methylbenzoxazole
Benzoxazole, 5-chloro-2-methyl-
5-Chloro-2-methyl-1,3-benzoxazole
EINECS 242-888-4
BENZOXAZOLE,5-CHLORO-2-METHYL
5-Chloro-2-methylbenzo[d]oxazole
2-Methyl-5-chlorobenzoxazole
5-Chlor-2-methyl-benzoxazol
MFCD00022850

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
241.6±13.0 °C at 760 mmHg

[ Melting Point ]:
55-57 °C(lit.)

[ Molecular Formula ]:
C8H6ClNO

[ Molecular Weight ]:
167.592

[ Flash Point ]:
99.9±19.8 °C

[ Exact Mass ]:
167.013794

[ PSA ]:
26.03000

[ LogP ]:
2.42

[ Vapour Pressure ]:
0.1±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.608

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DM4790000
CHEMICAL NAME :
Benzoxazole, 5-chloro-2-methyl-
CAS REGISTRY NUMBER :
19219-99-9
BEILSTEIN REFERENCE NO. :
0120800
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C8-H6-Cl-N-O
MOLECULAR WEIGHT :
167.60
WISWESSER LINE NOTATION :
T56 BN DOJ C1 HG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 4(1),339,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 4(1),337,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1550 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 4(1),337,1964

Safety Information

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S27-S36/37/39-S45-S36/39

[ RIDADR ]:
UN 1759 8/PG 2

[ WGK Germany ]:
3

[ RTECS ]:
DM4790000

[ Packaging Group ]:
III

[ Hazard Class ]:
8

[ HS Code ]:
29349990

Synthetic Route

Precursor & DownStream

Precursor

  • Triethyl orthoacetate
  • 2-Amino-4-chlorophenol
  • 4-chloro-6-[1-(hydroxyamino)ethylidene]cyclohexa-2,4-dien-1-one
  • N-(5-chloro-2-hydroxyphenyl)acetamide
  • 2-Amino-5-chlorophenol
  • SodiuM bicarbonate
  • 1,1,1-Trimethoxyethane
  • 2-nitro-4-chlorophenol
  • Ethanoic anhydride

DownStream

  • 2-methylbenzoxazole
  • 5-(sec-butoxy)-2-methylbenzoxazole
  • 2-Methyl-5-phenylbenzoxazole
  • 2-METHYLBENZO[D]OXAZOL-5-AMINE
  • 5-Methoxy-2-methylbenzoxazole
  • 5-Chloro-2-Methyl-6-Nitrobenzoxazole
  • 4-amino-2-chloro-5-hydroxybenzenesulfonic acid

Customs

[ HS Code ]: 2934999090

[ Summary ]:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%


Related Compounds

  • 5-Bromo-7-chloro-2-methylbenzo[d]oxazole
  • 5-chloro-3-methylbenzo[d]oxazole-2(3H)-thione
  • 5-Chloro-2-Morpholinobenzo[d]oxazole
  • 5-Chloro-2-(trifluoromethyl)benzo[d]oxazole
  • 5-chloro-2-(2-fluorophenyl)benzo[d]oxazole
  • 5-Chloro-2-oxo-benzooxazole-3-carboxylic acid phenyl ester
  • tert-butyl N-(6-amino-5-hydroxy-2,2-dimethylhexan-3-yl)carbamate
  • 2-[6-(Pyrrolidin-1-yl)pyridin-3-yl]butanoic acid
  • Tert-butyl 4-(fluoromethyl)-2-azaspiro[4.4]nonane-2-carboxylate
  • benzyl N-(4-methyl-3-sulfamoylphenyl)carbamate
  • 1-(2-tert-butyl-2H-1,2,3,4-tetrazol-5-yl)-4,4-difluorocyclohexane-1-carboxylic acid
  • 1-amino-2-(1-methyl-2,3-dihydro-1H-indol-5-yl)propan-2-ol
  • [(1S)-1-(4-bromophenyl)ethyl](ethyl)amine hydrochloride
  • rac-(3R,4R)-4-(cyclopropylmethyl)-1-(2,2,2-trifluoroacetyl)pyrrolidine-3-carboxylic acid
  • 3,3-Dimethyl-1-[(2,2,2-trifluoroacetamido)methyl]-2-oxabicyclo[2.1.1]hexane-4-carboxylic acid
  • 5-{[(Tert-butoxy)carbonyl]amino}pyridazine-3-carboxylic acid
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