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Home > Encyclopedia > 6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine

6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine

6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine structure

6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine 

structure
  • CAS No:

    85850-82-4

  • Formula:

    C25H22OS

  • Chemical Name:

    6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine

  • Synonyms:

    UNII-KJR8G40Q9L;KJR8G40Q9L;DIBENZO(b,f)THIEPIN, 3-(ALLYLOXY)-10-ETHYL-11-PHENYL-;85850-82-4;BRN 5611181;3-(Allyloxy)-10-ethyl-11-phenyldibenzo(b,f)thiepin;CHEMBL14560;DTXSID70235120;3-(Allyloxy)-10-ethyl-11-phenyl dibenzo(b,f)thiepin

6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine Basic Attributes

370.5 g/mol

370.13913649 g/mol

KJR8G40Q9L

DTXSID70235120

Characteristics

34.5 Ų

7.0851

111 - 112 °C (ethanol)

Toxicity

Name Type of Test Exposure Route Species Observed Dose/Duration Toxic Effects Reference
REPRODUCTIVE DATA TDLo - Lowest published toxic dose Oral Rodent - rat 30 mg/kg,female 3 day(s) pre-mating Reproductive-Maternal Effects-uterus, cervix, vagina Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 26,1131,1983

Computed Properties

Molecular Weight:370.5
XLogP3:6.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:370.13913649
Monoisotopic Mass:370.13913649
Topological Polar Surface Area:34.5
Heavy Atom Count:27
Complexity:532
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine

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