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Benzo[b]naphtho[1,2-d]thiophene - >98.0%, high purity , CAS No.205-43-6

COA

Grade & Purity:

≥98%

Cas Number: 205-43-6
Molecular Weight: 234.32
MDL number: MFCD00215942
PubChem CID: 9151
PubChem SID: 504751793

In stock

Item Number

B152947

Grouped product items
SKU	Size	Availability	Price
B152947-1g	1g	3	$124.90
B152947-5g	5g	3	$298.90
B152947-10g	10g	3	$536.90
B152947-25g	25g	3	$1,208.90
B152947-50g	50g	2	$2,174.90

View related series

Five-Membered Heterocyclic Compounds (2064) thiophenes (401)

Basic Description

Synonyms	AKOS027382113 \| 3,4-Benzo-9-thiafluorene \| J-519695 \| Naphtho[2,1-b]thianaphthene \| DTXSID4075370 \| F16260 \| BENZO (b) NAPHTHO (1,2-d) THIOPHENE (purity) \| SY055845 \| Benzo(b)naphtho(1,2-d)thiophene \| XZUMOEVHCZXMTR-UHFFFAOYSA-N \| A855048 \| 5-17-02-00434
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Naphthalenes
    - Subclass Naphthothiophenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Naphthothiophenes
Intermediate Tree Nodes	Not available
Direct Parent	Naphthothiophenes
Alternative Parents	Dibenzothiophenes 1-benzothiophenes Thiophenes Heteroaromatic compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Naphthothiophene - Dibenzothiophene - 1-benzothiophene - Benzothiophene - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthothiophenes. These are compounds containing a naphthalene (or a derivative) fused to thiophene.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504751793
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504751793
IUPAC Name	naphtho[2,1-b][1]benzothiole
INCHI	InChI=1S/C16H10S/c1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-15/h1-10H
InChIKey	XZUMOEVHCZXMTR-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4S3
Isomeric SMILES	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4S3
RTECS	DI2340000
Molecular Weight	234.32
Reaxy-Rn	9635
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9635&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
I1713069	Certificate of Analysis	Apr 02, 2025	B152947
E2203088	Certificate of Analysis	Feb 24, 2022	B152947
E2203085	Certificate of Analysis	Feb 24, 2022	B152947
E2203076	Certificate of Analysis	Feb 24, 2022	B152947
E2203091	Certificate of Analysis	Feb 24, 2022	B152947

Chemical and Physical Properties

Solubility	Slightly soluble (2.8E-5 g/L) (25 ºC)
Sensitivity	Heat Sensitive
Boil Point(°C)	220°C/0.2mmHg(lit.)
Melt Point(°C)	185 ºC
Molecular Weight	234.300 g/mol
XLogP3	5.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	234.05 Da
Monoisotopic Mass	234.05 Da
Topological Polar Surface Area	28.200 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	287.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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