2-(5-Chlorobenzo[b]thiophen-3-yl)acetic acid

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Names

[ CAS No. ]:
17266-30-7

[ Name ]:
2-(5-Chlorobenzo[b]thiophen-3-yl)acetic acid

[Synonym ]:
2-(5-chloro-1-benzothiophen-3-yl)acetic acid
MFCD00052308
5-Chlorobenzo[b]thiophene-3-acetic acid
5-Chlorothianaphthene-3-acetic acid

Chemical & Physical Properties

[ Density]:
1.487 g/cm3

[ Boiling Point ]:
410.6ºC at 760 mmHg

[ Melting Point ]:
148-150°C

[ Molecular Formula ]:
C10H7ClO2S

[ Molecular Weight ]:
226.67900

[ Flash Point ]:
202.1ºC

[ Exact Mass ]:
225.98600

[ PSA ]:
65.54000

[ LogP ]:
3.18180

[ Vapour Pressure ]:
1.77E-07mmHg at 25°C

[ Index of Refraction ]:
1.693

[ Storage condition ]:
2-8°C

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DL8895000
CHEMICAL NAME :
Benzo(b)thiophene-3-acetic acid, 5-chloro-
CAS REGISTRY NUMBER :
17266-30-7
BEILSTEIN REFERENCE NO. :
1244795
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H7-Cl-O2-S
MOLECULAR WEIGHT :
226.68

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 :
>512 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JSOOAX Journal of the Chemical Society, Section C: Organic. (London, UK) No.1-24, 1966-71. For publisher information, see JCPRB4. Volume(issue)/page/year: (12),1612,1969

Safety Information

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RTECS ]:
DL8895000

[ HS Code ]:
2934999090

Precursor & DownStream

Precursor

  • 5-chlorothianaphthene-3-acetonitrile

DownStream

  • [3-(5-chloro-1-benzothiophen-3-yl)-2-oxopropyl] acetate
  • METHYL 2-(5-CHLOROBENZO[B]THIOPHEN-3-YL)ACETATE

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

  • 1,1a(2)-(2-Cyclopropylethylidene)bis[benzene]
  • Lithium-2-isopropylphenyl
  • Carvone-5,6-oxide, cis-(+)-
  • 3-[(Iodomethyl)thio]-1-(triphenylmethyl)-1H-1,2,4-triazole
  • N-methyl-6-nitro-1,3-benzodioxol-5-amine
  • (3S)-3-cyclohexyl-3-hydroxypropanoic acid
  • 1,1,1-trifluoro-3-(2-furyl)propan-2-ol
  • Ethyl 2-(2-((2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)thio)acetamido)acetate
  • 5-(benzylthio)-7-(4-methoxyphenyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
  • 1,3-dimethyl-7-(4-nitrophenyl)-5-((2-oxo-2-(pyrrolidin-1-yl)ethyl)thio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
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