![6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran structure](/static/products/1005/1005188-62-4.webp)
6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran
TL;DR: 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran (CAS 1005188-62-4) is a chemical compound with molecular formula C19H23ClOS and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-thiochromene
Also Known As: 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran, 6-chloro-4-[(2,4-dimethylbenzyl)oxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-thiochromene, 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-thiochromene, 2H-1-Benzothiopyran, 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-3,4,4a,8a-tetrahydro-2-methyl-
| Molecular Formula | C19H23ClOS |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 5.39134 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.1158 |
| Heavy Atoms | 22 |
| Complexity | 607.45276 |
Chemical Identifiers
| CAS Number | 1005188-62-4 |
|---|---|
| SMILES | CC1CC(C2C=C(C=CC2S1)Cl)OCC3=C(C=C(C=C3)C)C |
Product Overview
6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran (CAS 1005188-62-4), with molecular formula C19H23ClOS and molecular weight 334.12 g/mol. IUPAC: 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-thiochromene.
Chemical Property Profile of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran
Property Insights of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran
The XLogP value of 5.39134 indicates that 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran?
The CAS number of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran is 1005188-62-4.
What is the molecular formula of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran?
The molecular formula of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran is C19H23ClOS.
What is the molecular weight of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran?
The molecular weight of 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran is 334.12 g/mol.
Where can I buy 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran?
You can request a quote for 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-4-[(2,4-dimethylphenyl)methoxy]-2-methyl-3,4,4a,8a-tetrahydro-2H-1-benzothiopyran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.