β,β-二甲基-1H-咪唑-4-乙胺
TL;DR: β,β-二甲基-1H-咪唑-4-乙胺 (CAS 21150-01-6) is a chemical compound with molecular formula C7H13N3 and molecular weight 139.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
β,β-二甲基-1H-咪唑-4-乙胺
2-(1H-imidazol-5-yl)-2-methylpropan-1-amine
Also Known As: beta,beta-Dimethylhistamine, 2-(1H-imidazol-5-yl)-2-methylpropan-1-amine, .beta.,.beta.-Dimethylhistamine, BETA,BETA-DIMETHYL-1H-IMIDAZOLE-4-ETHANAMINE, Imidazole, 4-(2-amino-1,1-dimethylethyl)-
| Molecular Formula | C7H13N3 |
|---|---|
| Molecular Weight | 139.11 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 139.11095 |
| Heavy Atoms | 10 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 21150-01-6 |
|---|---|
| SMILES | CC(C)(CN)C1=CN=CN1 |
| InChIKey | OKJUBHQJVNBSOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
β,β-二甲基-1H-咪唑-4-乙胺 (CAS 21150-01-6), with molecular formula C7H13N3 and molecular weight 139.11 g/mol. IUPAC: 2-(1H-imidazol-5-yl)-2-methylpropan-1-amine.
Chemical Property Profile of β,β-二甲基-1H-咪唑-4-乙胺
Property Insights of β,β-二甲基-1H-咪唑-4-乙胺
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for β,β-二甲基-1H-咪唑-4-乙胺. With a topological polar surface area (TPSA) of 54.7 Ų, β,β-二甲基-1H-咪唑-4-乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, β,β-二甲基-1H-咪唑-4-乙胺 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 β,β-二甲基-1H-咪唑-4-乙胺?
The CAS number of β,β-二甲基-1H-咪唑-4-乙胺 is 21150-01-6.
What is the molecular formula of β,β-二甲基-1H-咪唑-4-乙胺?
The molecular formula of β,β-二甲基-1H-咪唑-4-乙胺 is C7H13N3.
What is the molecular weight of β,β-二甲基-1H-咪唑-4-乙胺?
The molecular weight of β,β-二甲基-1H-咪唑-4-乙胺 is 139.11 g/mol.
Where can I buy β,β-二甲基-1H-咪唑-4-乙胺?
You can request a quote for β,β-二甲基-1H-咪唑-4-乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for β,β-二甲基-1H-咪唑-4-乙胺?
Yes, KEHONG BIO provides custom synthesis services for β,β-二甲基-1H-咪唑-4-乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.