Cas no 22108-55-0 (Anthra[2,3-b]thiophene)
Anthra[2,3-b]thiophene structure
Product Name:Anthra[2,3-b]thiophene
Anthra[2,3-b]thiophene Chemical and Physical Properties
Names and Identifiers
-
- Anthra[2,3-b]thiophene
- naphtho[2,3-f][1]benzothiole
- SCHEMBL4585002
- BRN 4416197
- ANTHRA(2,3-b)THIOPHENE
- 22108-55-0
- QOOSFVFWJXNCTP-UHFFFAOYSA-N
- DTXSID70176620
-
- Inchi: 1S/C16H10S/c1-2-4-12-8-15-10-16-13(5-6-17-16)9-14(15)7-11(12)3-1/h1-10H
- InChI Key: QOOSFVFWJXNCTP-UHFFFAOYSA-N
- SMILES: S1C=CC2=C1C=C1C=C3C=CC=CC3=CC1=C2
Computed Properties
- Exact Mass: 234.0504
- Monoisotopic Mass: 234.050321
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 287
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 28.2
- XLogP3: 4.9
Experimental Properties
- Density: 1.292
- Boiling Point: 440.7°C at 760 mmHg
- Flash Point: 166.1°C
- Refractive Index: 1.809
- PSA: 0
Anthra[2,3-b]thiophene Related Literature
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Adam Pron,Pawel Gawrys,Malgorzata Zagorska,David Djurado,Renaud Demadrille Chem. Soc. Rev. 2010 39 2577
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M. Shaheer Malik,Reem I. Alsantali,Rabab S. Jassas,Abdulrahman A. Alsimaree,Riyaz Syed,Meshari A. Alsharif,Kulkarni Kalpana,Moataz Morad,Ismail I. Althagafi,Saleh A. Ahmed RSC Adv. 2021 11 35806
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