benzo[b]naphtho[1,2-d]thiophene

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Names

[ CAS No. ]:
205-43-6

[ Name ]:
benzo[b]naphtho[1,2-d]thiophene

[Synonym ]:
Benzo[b]naphtho[1,2-d]thiophene
Naphtho[2,1-b]thianaphthene
BCR137R_FLUKA
benzo<b>naphtho<1,2-b>thiophene
Benzo<b>naphthto<1,2-d>thiophene
Benzo[a]dibenzothiophene
BENZO(B)NAPHTHO(1,2-D)THIOPHENE

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
434.3±14.0 °C at 760 mmHg

[ Melting Point ]:
185℃ (acetic acid )

[ Molecular Formula ]:
C16H10S

[ Molecular Weight ]:
234.316

[ Flash Point ]:
163.0±6.3 °C

[ Exact Mass ]:
234.050323

[ PSA ]:
28.24000

[ LogP ]:
5.61

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.810

[ Storage condition ]:
2-8°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DI2340000
CHEMICAL NAME :
Benzo(b)naphtho(1,2-d)thiophene
CAS REGISTRY NUMBER :
205-43-6
BEILSTEIN REFERENCE NO. :
0009635
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H10-S
MOLECULAR WEIGHT :
234.32

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
40 ug/plate
REFERENCE :
CRTOEC Chemical Research in Toxicology. (American Chemical Soc., Distribution Office Dept. 223, POB 57/36, West End Station, Washington, DC 20037) V.1- 1988- Volume(issue)/page/year: 3,93,1990

Safety Information

[ RTECS ]:
DI2340000

[ HS Code ]:
2934999090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3-[1-(2-fluorophenyl)naphthalen-2-ylsulfanyl]propionic acid ethyl ester
  • naphtho[2,1-b][1]benzothiole 7,7-dioxide
  • 2,3,5,6-tetrahydronaphtho[2,1-b]benzo[b]thiophen-4(1H)-one
  • 1-(2-fluorophenyl)naphthalen-2-ol
  • 2-Fluorophenylboronic acid
  • 1-PHENYLNAPHTHALENE

DownStream

  • 1-PHENYLNAPHTHALENE
  • 1-phenyl-1,2,3,4-tetrahydronaphthalene
  • 5-phenyl-1,2,3,4-tetrahydronaphthalene
  • tetrahydro(1,2,3,4)benzo(b)naphto<1,2-d>thiophene

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%

Articles

The predominant role of S-oxidation in rat liver metabolism of thiaarenes.

Cancer Lett. 32(1) , 107-16, (1986)

Thiaarenes are metabolized by liver microsomes of untreated rats predominantly to sulfones and sulfoxides. After pretreatment of rats with monooxygenase inducers, ring oxidation of thiaarenes is also ...

Towards β-selectivity in functional estrogen receptor antagonists.

Org. Biomol. Chem. 10(36) , 7334-46, (2012)

Based on the benzo[b]naphtho[1,2-d]furan and benzo[b]naphtho[1,2-d]thiophene frameworks, a series of ligands with different basic side chains (BSCs) has been synthesized and pharmacologically evaluate...


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Related Compounds

  • benzo[b]naphtho[1,2-d]thiophene
  • 5-Bromobenzo[b]naphtho[1,2-d]thiophene
  • benzo[b]naphtho[1,2-d]thiophene 7,7-dioxide
  • 5,6-dihydro-benzo[b]naphtho[1,2-d]thiophene
  • benzo[b]naphtho[1,2-d]thiophene-5-carboxylic acid
  • 1,2,3,4-tetrahydrobenzo[b]naphtho[1,2-d]thiophene
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 3-(2-ethyl-4-methyl-1H-imidazol-1-yl)-4-propylcyclohexan-1-ol
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • N-(3,4-dihydro-2H-1-benzopyran-4-yl)-2-[4-(4-iodophenyl)piperazin-1-yl]acetamide
  • 2-Amino-2-[3-(methoxymethyl)furan-2-yl]acetic acid
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde