3,3-Bis(1-aziridinyl)propionitrile
TL;DR: 3,3-Bis(1-aziridinyl)propionitrile (CAS 1004-67-7) is a chemical compound with molecular formula C1CN1C(CC#N)N2CC2 and molecular weight 137.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(aziridin-1-yl)propanenitrile
Also Known As: 3,3-bis(aziridin-1-yl)propanenitrile, 3,3-Bis(1-aziridinyl)propionitrile, 3,3-Di(aziridin-1-yl)propanenitrile, Pyrimidine, 2,4,5,6-tetraamino-, Propionitrile, 3,3-bis(1-aziridinyl)-
| Molecular Formula | C1CN1C(CC#N)N2CC2 |
|---|---|
| Molecular Weight | 137.10 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 29.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 137.09529 |
| Heavy Atoms | 10 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 1004-67-7 |
|---|---|
| SMILES | C1CN1C(CC#N)N2CC2 |
| InChIKey | TZZNYICTGMOBTG-UHFFFAOYSA-N |
Product Overview
3,3-Bis(1-aziridinyl)propionitrile (CAS 1004-67-7), with molecular formula C1CN1C(CC#N)N2CC2 and molecular weight 137.10 g/mol. IUPAC: 3,3-bis(aziridin-1-yl)propanenitrile.
Chemical Property Profile of 3,3-Bis(1-aziridinyl)propionitrile
Property Insights of 3,3-Bis(1-aziridinyl)propionitrile
The XLogP value of -0.3 indicates that 3,3-Bis(1-aziridinyl)propionitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.8 Ų, 3,3-Bis(1-aziridinyl)propionitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Bis(1-aziridinyl)propionitrile 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 3,3-Bis(1-aziridinyl)propionitrile?
The CAS number of 3,3-Bis(1-aziridinyl)propionitrile is 1004-67-7.
What is the molecular formula of 3,3-Bis(1-aziridinyl)propionitrile?
The molecular formula of 3,3-Bis(1-aziridinyl)propionitrile is C1CN1C(CC#N)N2CC2.
What is the molecular weight of 3,3-Bis(1-aziridinyl)propionitrile?
The molecular weight of 3,3-Bis(1-aziridinyl)propionitrile is 137.10 g/mol.
Where can I buy 3,3-Bis(1-aziridinyl)propionitrile?
You can request a quote for 3,3-Bis(1-aziridinyl)propionitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Bis(1-aziridinyl)propionitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Bis(1-aziridinyl)propionitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.