4,4'-(甲基亚氨基)二丁腈
TL;DR: 4,4'-(甲基亚氨基)二丁腈 (CAS 89690-18-6) is a chemical compound with molecular formula C9H15N3 and molecular weight 165.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4'-(甲基亚氨基)二丁腈
4-[3-cyanopropyl(methyl)amino]butanenitrile
Also Known As: Di(3-cianopropil)metilammina, 4,4'-(Methylimino)dibutyronitrile, Di(3-cianopropil)metilammina [Italian], BUTYRONITRILE, 4,4'-(METHYLIMINO)DI-, 2516 I.S.
| Molecular Formula | C9H15N3 |
|---|---|
| Molecular Weight | 165.13 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 165.1266 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 89690-18-6 |
|---|---|
| SMILES | CN(CCCC#N)CCCC#N |
| InChIKey | MFTBTGABLVJMGK-UHFFFAOYSA-N |
Product Overview
4,4'-(甲基亚氨基)二丁腈 (CAS 89690-18-6), with molecular formula C9H15N3 and molecular weight 165.13 g/mol. IUPAC: 4-[3-cyanopropyl(methyl)amino]butanenitrile.
Chemical Property Profile of 4,4'-(甲基亚氨基)二丁腈
Property Insights of 4,4'-(甲基亚氨基)二丁腈
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(甲基亚氨基)二丁腈. With a topological polar surface area (TPSA) of 50.8 Ų, 4,4'-(甲基亚氨基)二丁腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-(甲基亚氨基)二丁腈 has 0 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 4,4'-(甲基亚氨基)二丁腈?
The CAS number of 4,4'-(甲基亚氨基)二丁腈 is 89690-18-6.
What is the molecular formula of 4,4'-(甲基亚氨基)二丁腈?
The molecular formula of 4,4'-(甲基亚氨基)二丁腈 is C9H15N3.
What is the molecular weight of 4,4'-(甲基亚氨基)二丁腈?
The molecular weight of 4,4'-(甲基亚氨基)二丁腈 is 165.13 g/mol.
Where can I buy 4,4'-(甲基亚氨基)二丁腈?
You can request a quote for 4,4'-(甲基亚氨基)二丁腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(甲基亚氨基)二丁腈?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(甲基亚氨基)二丁腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.