1,4-Butanediamine, N-(3-methyl-1-butenyl)-
TL;DR: 1,4-Butanediamine, N-(3-methyl-1-butenyl)- (CAS 102308-91-8) is a chemical compound with molecular formula C9H20N2 and molecular weight 156.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(E)-3-methylbut-1-enyl]butane-1,4-diamine
Also Known As: Isoamyleneputrescine, N-(3-Methyl-1-butenyl)-1,4-butanediamine, 1,4-BUTANEDIAMINE, N-(3-METHYL-1-BUTENYL)-, N'-[(E)-3-methylbut-1-enyl]butane-1,4-diamine, RefChem:1053219
| Molecular Formula | C9H20N2 |
|---|---|
| Molecular Weight | 156.16 g/mol |
| LogP | 1.4846 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 156.16264 |
| Heavy Atoms | 11 |
| Complexity | 97.735855 |
Chemical Identifiers
| CAS Number | 102308-91-8 |
|---|---|
| SMILES | CC(C)/C=C/NCCCCN |
Product Overview
1,4-Butanediamine, N-(3-methyl-1-butenyl)- (CAS 102308-91-8), with molecular formula C9H20N2 and molecular weight 156.16 g/mol. IUPAC: N'-[(E)-3-methylbut-1-enyl]butane-1,4-diamine.
Chemical Property Profile of 1,4-Butanediamine, N-(3-methyl-1-butenyl)-
Property Insights of 1,4-Butanediamine, N-(3-methyl-1-butenyl)-
The XLogP value of 1.4846 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Butanediamine, N-(3-methyl-1-butenyl)-. With a topological polar surface area (TPSA) of 38.05 Ų, 1,4-Butanediamine, N-(3-methyl-1-butenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Butanediamine, N-(3-methyl-1-butenyl)- 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 1,4-Butanediamine, N-(3-methyl-1-butenyl)-?
The CAS number of 1,4-Butanediamine, N-(3-methyl-1-butenyl)- is 102308-91-8.
What is the molecular formula of 1,4-Butanediamine, N-(3-methyl-1-butenyl)-?
The molecular formula of 1,4-Butanediamine, N-(3-methyl-1-butenyl)- is C9H20N2.
What is the molecular weight of 1,4-Butanediamine, N-(3-methyl-1-butenyl)-?
The molecular weight of 1,4-Butanediamine, N-(3-methyl-1-butenyl)- is 156.16 g/mol.
Where can I buy 1,4-Butanediamine, N-(3-methyl-1-butenyl)-?
You can request a quote for 1,4-Butanediamine, N-(3-methyl-1-butenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Butanediamine, N-(3-methyl-1-butenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Butanediamine, N-(3-methyl-1-butenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.