N-(4-氯苯基)-N-甲基乙二胺
TL;DR: N-(4-氯苯基)-N-甲基乙二胺 (CAS 21647-84-7) is a chemical compound with molecular formula C9H13ClN2 and molecular weight 184.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-氯苯基)-N-甲基乙二胺
N'-(4-chlorophenyl)-N'-methylethane-1,2-diamine
Also Known As: N-(4-Chlorophenyl)-N-methylethylenediamine, N-(2-aminoethyl)-4-chloro-N-methylaniline, N'-(4-chlorophenyl)-N'-methylethane-1,2-diamine, n-(4-chlorophenyl)-n-methylethane-1,2-diamine, N-(p-Chlorophenyl)-N-methylethane-1,2-diamine
| Molecular Formula | C9H13ClN2 |
|---|---|
| Molecular Weight | 184.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07672 |
| Heavy Atoms | 12 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 21647-84-7 |
|---|---|
| SMILES | CN(CCN)C1=CC=C(C=C1)Cl |
| InChIKey | NEUAPOAFUOOCQR-UHFFFAOYSA-N |
Product Overview
N-(4-氯苯基)-N-甲基乙二胺 (CAS 21647-84-7), with molecular formula C9H13ClN2 and molecular weight 184.08 g/mol. IUPAC: N'-(4-chlorophenyl)-N'-methylethane-1,2-diamine.
Chemical Property Profile of N-(4-氯苯基)-N-甲基乙二胺
Property Insights of N-(4-氯苯基)-N-甲基乙二胺
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-氯苯基)-N-甲基乙二胺. With a topological polar surface area (TPSA) of 29.3 Ų, N-(4-氯苯基)-N-甲基乙二胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-氯苯基)-N-甲基乙二胺 has 1 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 N-(4-氯苯基)-N-甲基乙二胺?
The CAS number of N-(4-氯苯基)-N-甲基乙二胺 is 21647-84-7.
What is the molecular formula of N-(4-氯苯基)-N-甲基乙二胺?
The molecular formula of N-(4-氯苯基)-N-甲基乙二胺 is C9H13ClN2.
What is the molecular weight of N-(4-氯苯基)-N-甲基乙二胺?
The molecular weight of N-(4-氯苯基)-N-甲基乙二胺 is 184.08 g/mol.
Where can I buy N-(4-氯苯基)-N-甲基乙二胺?
You can request a quote for N-(4-氯苯基)-N-甲基乙二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-氯苯基)-N-甲基乙二胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-氯苯基)-N-甲基乙二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.