1,2-Ethanediamine, N1-phenyl-
TL;DR: 1,2-Ethanediamine, N1-phenyl- (CAS 1664-40-0) is a chemical compound with molecular formula C8H12N2 and molecular weight 136.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-phenylethane-1,2-diamine
Also Known As: N-Phenylethylenediamine, N1-Phenylethane-1,2-diamine, N-(2-Aminoethyl)aniline, Ethylenediamine, N-phenyl-, N-Phenyl-1,2-ethanediamine
| Molecular Formula | C8H12N2 |
|---|---|
| Molecular Weight | 136.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 136.10005 |
| Heavy Atoms | 10 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 1664-40-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NCCN |
| InChIKey | OCIDXARMXNJACB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Ethanediamine, N1-phenyl- (CAS 1664-40-0), with molecular formula C8H12N2 and molecular weight 136.10 g/mol. IUPAC: N'-phenylethane-1,2-diamine.
Chemical Property Profile of 1,2-Ethanediamine, N1-phenyl-
Property Insights of 1,2-Ethanediamine, N1-phenyl-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Ethanediamine, N1-phenyl-. With a topological polar surface area (TPSA) of 38.1 Ų, 1,2-Ethanediamine, N1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Ethanediamine, N1-phenyl- has 2 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 1,2-Ethanediamine, N1-phenyl-?
The CAS number of 1,2-Ethanediamine, N1-phenyl- is 1664-40-0.
What is the molecular formula of 1,2-Ethanediamine, N1-phenyl-?
The molecular formula of 1,2-Ethanediamine, N1-phenyl- is C8H12N2.
What is the molecular weight of 1,2-Ethanediamine, N1-phenyl-?
The molecular weight of 1,2-Ethanediamine, N1-phenyl- is 136.10 g/mol.
Where can I buy 1,2-Ethanediamine, N1-phenyl-?
You can request a quote for 1,2-Ethanediamine, N1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Ethanediamine, N1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Ethanediamine, N1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.