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2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline structure
Fine Chemical

2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline

TL;DR: 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline (CAS 1071700-39-4) is a chemical compound with molecular formula C17H19NOS and molecular weight 285.11874 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline

Also Known As: 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline, [2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)phenyl]amine, 2-{4H,5AH,6H,7H,8H,9H,9AH-THIENO[3,2-C]CHROMEN-4-YL}ANILINE, 2-(5a,6,7,8,9,9a-Hexahydro-4H-thieno3,2-cchromen-4-yl)phenylamine, 2-(6,7,8,9,5a,9a-hexahydro-4H-thiopheno[3,2-c]chromen-4-yl)phenylamine

CAS Number
1071700-39-4
Molecular Formula
C17H19NOS
Molecular Weight
285.11874 g/mol
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Technical Specifications

Molecular FormulaC17H19NOS
Molecular Weight285.11874 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)63.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds1
Exact Mass285.11874 Da
Heavy Atoms20
Complexity350.0
SMILESC1CCC2C(C1)C3=C(C=CS3)C(O2)C4=CC=CC=C4N
InChIKeyVBTAIIORPJWNIB-UHFFFAOYSA-N

Chemical Property Profile of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline

XLogP
3.6
TPSA (Topological Polar Surface Area)
63.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
1
Heavy Atoms
20
Complexity
350.0
Exact Mass
285.11874
Monoisotopic Mass
285.11874
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline

The XLogP value of 3.6 indicates that 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline. Following Lipinski's Rule of Five, 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline?

The CAS number of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline is 1071700-39-4.

What is the molecular formula of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline?

The molecular formula of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline is C17H19NOS.

What is the molecular weight of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline?

The molecular weight of 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline is 285.11874 g/mol.

Where can I buy 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline?

You can request a quote for 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline?

Yes, CoreyChem provides custom synthesis services for 2-(5a,6,7,8,9,9a-hexahydro-4H-thieno[3,2-c]chromen-4-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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