butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate
TL;DR: butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate (CAS 91972-85-9) is a chemical compound with molecular formula C13H24N2O and molecular weight 224.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate
Also Known As: butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate
| Molecular Formula | C13H24N2O |
|---|---|
| Molecular Weight | 224.19 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 224.18886 |
| Heavy Atoms | 16 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 91972-85-9 |
|---|---|
| SMILES | CCC(C)OC(=N)N(CC(=C)C)CC(=C)C |
| InChIKey | JTURXJHVQBQMDJ-UHFFFAOYSA-N |
Product Overview
butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate (CAS 91972-85-9), with molecular formula C13H24N2O and molecular weight 224.19 g/mol. IUPAC: butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate.
Chemical Property Profile of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate
Property Insights of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate
The XLogP value of 4.1 indicates that butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.3 Ų, butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate 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 butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate?
The CAS number of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate is 91972-85-9.
What is the molecular formula of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate?
The molecular formula of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate is C13H24N2O.
What is the molecular weight of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate?
The molecular weight of butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate is 224.19 g/mol.
Where can I buy butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate?
You can request a quote for butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate?
Yes, KEHONG BIO provides custom synthesis services for butan-2-yl N,N-bis(2-methylprop-2-enyl)carbamimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.