二丙炔胺
TL;DR: 二丙炔胺 (CAS 6921-28-4) is a chemical compound with molecular formula C6H7N and molecular weight 93.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二丙炔胺
N-prop-2-ynylprop-2-yn-1-amine
Also Known As: Dipropargylamine, DI-2-PROPYNYLAMINE, Di(2-propynyl)amine, 2-Propyn-1-amine, N-2-propynyl-, N-prop-2-ynylprop-2-yn-1-amine
| Molecular Formula | C6H7N |
|---|---|
| Molecular Weight | 93.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 93.057846 |
| Heavy Atoms | 7 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 6921-28-4 |
|---|---|
| SMILES | C#CCNCC#C |
| InChIKey | RGSODMOUXWISAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二丙炔胺 (CAS 6921-28-4), with molecular formula C6H7N and molecular weight 93.06 g/mol. IUPAC: N-prop-2-ynylprop-2-yn-1-amine.
Chemical Property Profile of 二丙炔胺
Property Insights of 二丙炔胺
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二丙炔胺. With a topological polar surface area (TPSA) of 12.0 Ų, 二丙炔胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二丙炔胺 has 1 hydrogen bond donor(s) and 1 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 二丙炔胺?
The CAS number of 二丙炔胺 is 6921-28-4.
What is the molecular formula of 二丙炔胺?
The molecular formula of 二丙炔胺 is C6H7N.
What is the molecular weight of 二丙炔胺?
The molecular weight of 二丙炔胺 is 93.06 g/mol.
Where can I buy 二丙炔胺?
You can request a quote for 二丙炔胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二丙炔胺?
Yes, KEHONG BIO provides custom synthesis services for 二丙炔胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.