1,2-Dimethylpropylamine
TL;DR: 1,2-Dimethylpropylamine (CAS 598-74-3) is a chemical compound with molecular formula C5H13N and molecular weight 87.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbutan-2-amine
Also Known As: 1,2-Dimethylpropylamine, 3-methylbutan-2-amine, 3-Methyl-2-butanamine, iso-Amylamine, 2-Butanamine, 3-methyl-
| Molecular Formula | C5H13N |
|---|---|
| Molecular Weight | 87.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 87.1048 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
Chemical Identifiers
| CAS Number | 598-74-3 |
|---|---|
| SMILES | CC(C)C(C)N |
| InChIKey | JOZZAIIGWFLONA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Dimethylpropylamine (CAS 598-74-3), with molecular formula C5H13N and molecular weight 87.10 g/mol. IUPAC: 3-methylbutan-2-amine.
Chemical Property Profile of 1,2-Dimethylpropylamine
Property Insights of 1,2-Dimethylpropylamine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethylpropylamine. With a topological polar surface area (TPSA) of 26.0 Ų, 1,2-Dimethylpropylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dimethylpropylamine has 1 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 1,2-Dimethylpropylamine?
The CAS number of 1,2-Dimethylpropylamine is 598-74-3.
What is the molecular formula of 1,2-Dimethylpropylamine?
The molecular formula of 1,2-Dimethylpropylamine is C5H13N.
What is the molecular weight of 1,2-Dimethylpropylamine?
The molecular weight of 1,2-Dimethylpropylamine is 87.10 g/mol.
Where can I buy 1,2-Dimethylpropylamine?
You can request a quote for 1,2-Dimethylpropylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethylpropylamine?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethylpropylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.