3-甲基-2-丁胺盐酸盐(1/1)
TL;DR: 3-甲基-2-丁胺盐酸盐(1/1) (CAS 31519-52-5) is a chemical compound with molecular formula C5H14ClN and molecular weight 123.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基-2-丁胺盐酸盐(1/1)
3-methylbutan-2-amine;hydrochloride
Also Known As: 1,2-Dimethylpropylamine hydrochloride, 3-methylbutan-2-amine;hydrochloride, 3-methylbutan-2-amine hydrochloride, 3-Methyl-2-aminobutane hydrochloride, 2-Amino-3-methylbutane hydrochloride
| Molecular Formula | C5H14ClN |
|---|---|
| Molecular Weight | 123.08 g/mol |
| LogP | 1.41 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 123.081474 |
| Heavy Atoms | 7 |
| Complexity | 32.0 |
Chemical Identifiers
| CAS Number | 31519-52-5 |
|---|---|
| SMILES | CC(C)C(C)N.Cl |
| InChIKey | RBOBXILUTBVQOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲基-2-丁胺盐酸盐(1/1) (CAS 31519-52-5), with molecular formula C5H14ClN and molecular weight 123.08 g/mol. IUPAC: 3-methylbutan-2-amine;hydrochloride.
Chemical Property Profile of 3-甲基-2-丁胺盐酸盐(1/1)
Property Insights of 3-甲基-2-丁胺盐酸盐(1/1)
The XLogP value of 1.41 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲基-2-丁胺盐酸盐(1/1). With a topological polar surface area (TPSA) of 26.0 Ų, 3-甲基-2-丁胺盐酸盐(1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲基-2-丁胺盐酸盐(1/1) has 2 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 3-甲基-2-丁胺盐酸盐(1/1)?
The CAS number of 3-甲基-2-丁胺盐酸盐(1/1) is 31519-52-5.
What is the molecular formula of 3-甲基-2-丁胺盐酸盐(1/1)?
The molecular formula of 3-甲基-2-丁胺盐酸盐(1/1) is C5H14ClN.
What is the molecular weight of 3-甲基-2-丁胺盐酸盐(1/1)?
The molecular weight of 3-甲基-2-丁胺盐酸盐(1/1) is 123.08 g/mol.
Where can I buy 3-甲基-2-丁胺盐酸盐(1/1)?
You can request a quote for 3-甲基-2-丁胺盐酸盐(1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-2-丁胺盐酸盐(1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-2-丁胺盐酸盐(1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.