2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺
TL;DR: 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 (CAS 17164-65-7) is a chemical compound with molecular formula C11H13Cl2NO2 and molecular weight 261.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺
2-(3,4-dichlorophenyl)-5-methyl-1,3-dioxan-5-amine
Also Known As: starbld0022199, 2-(3,4-dichlorophenyl)-5-methyl-1,3-dioxan-5-amine, m-DIOXAN-5-AMINE, 2-(3,4-DICHLOROPHENYL)-5-METHYL-, 5-Amino-5-methyl-2-(3,4-dichlorophenyl)-1,3-dioxane, 2-(3,4-dichlorophenyl)-5-methyl-m-dioxan-5-amine
| Molecular Formula | C11H13Cl2NO2 |
|---|---|
| Molecular Weight | 261.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.03235 |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 17164-65-7 |
|---|---|
| SMILES | CC1(COC(OC1)C2=CC(=C(C=C2)Cl)Cl)N |
| InChIKey | RYRMQVSKHWRIGN-UHFFFAOYSA-N |
Product Overview
2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 (CAS 17164-65-7), with molecular formula C11H13Cl2NO2 and molecular weight 261.03 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-5-methyl-1,3-dioxan-5-amine.
Chemical Property Profile of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺
Property Insights of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺. With a topological polar surface area (TPSA) of 44.5 Ų, 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 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
Frequently Asked Questions
What is the CAS number of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺?
The CAS number of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 is 17164-65-7.
What is the molecular formula of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺?
The molecular formula of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 is C11H13Cl2NO2.
What is the molecular weight of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺?
The molecular weight of 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 is 261.03 g/mol.
Where can I buy 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺?
You can request a quote for 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-二氯苯基)-5-甲基-间二噁烷-5-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.