2-氯-1-乙基-1H-吲哚-3,7-二甲醛
TL;DR: 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 (CAS 66335-13-5) is a chemical compound with molecular formula C12H10ClNO2 and molecular weight 235.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-1-乙基-1H-吲哚-3,7-二甲醛
2-chloro-1-ethylindole-3,7-dicarbaldehyde
Also Known As: 2-chloro-1-ethylindole-3,7-dicarbaldehyde, 2-Chloro-1-ethyl-1H-indole-3,7-dicarbaldehyde, 2-Chloro-1-ethyl-indole-3,7-dicarbaldehyde
| Molecular Formula | C12H10ClNO2 |
|---|---|
| Molecular Weight | 235.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 39.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.04001 |
| Heavy Atoms | 16 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 66335-13-5 |
|---|---|
| SMILES | CCN1C2=C(C=CC=C2C(=C1Cl)C=O)C=O |
| InChIKey | OBIRPWIAZKMYJU-UHFFFAOYSA-N |
Product Overview
2-氯-1-乙基-1H-吲哚-3,7-二甲醛 (CAS 66335-13-5), with molecular formula C12H10ClNO2 and molecular weight 235.04 g/mol. IUPAC: 2-chloro-1-ethylindole-3,7-dicarbaldehyde.
Chemical Property Profile of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛
Property Insights of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-1-乙基-1H-吲哚-3,7-二甲醛. With a topological polar surface area (TPSA) of 39.1 Ų, 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 has 0 hydrogen bond donor(s) and 2 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-氯-1-乙基-1H-吲哚-3,7-二甲醛?
The CAS number of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 is 66335-13-5.
What is the molecular formula of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛?
The molecular formula of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 is C12H10ClNO2.
What is the molecular weight of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛?
The molecular weight of 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 is 235.04 g/mol.
Where can I buy 2-氯-1-乙基-1H-吲哚-3,7-二甲醛?
You can request a quote for 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-1-乙基-1H-吲哚-3,7-二甲醛?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-1-乙基-1H-吲哚-3,7-二甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.