2-(叔丁氨基)-3-甲基丁-2-烯腈
TL;DR: 2-(叔丁氨基)-3-甲基丁-2-烯腈 (CAS 63364-14-7) is a chemical compound with molecular formula C9H16N2 and molecular weight 152.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(叔丁氨基)-3-甲基丁-2-烯腈
2-(tert-butylamino)-3-methylbut-2-enenitrile
Also Known As: 2-(tert-butylamino)-3-methylbut-2-enenitrile, 2-chloro-7H-purin-6-amine, 2-TERT-BUTYLAMINO-3-METHYLCROTONONITRILE 96+%, 2-Butenenitrile, 2-[(1,1-dimethylethyl)amino]-3-methyl-, 2-Butenenitrile,2-[(1,1-dimethylethyl)amino]-3-methyl-
| Molecular Formula | C9H16N2 |
|---|---|
| Molecular Weight | 152.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.13135 |
| Heavy Atoms | 11 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 63364-14-7 |
|---|---|
| SMILES | CC(=C(C#N)NC(C)(C)C)C |
| InChIKey | PPVWIPXCUJDBCZ-UHFFFAOYSA-N |
Product Overview
2-(叔丁氨基)-3-甲基丁-2-烯腈 (CAS 63364-14-7), with molecular formula C9H16N2 and molecular weight 152.13 g/mol. IUPAC: 2-(tert-butylamino)-3-methylbut-2-enenitrile.
Chemical Property Profile of 2-(叔丁氨基)-3-甲基丁-2-烯腈
Property Insights of 2-(叔丁氨基)-3-甲基丁-2-烯腈
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(叔丁氨基)-3-甲基丁-2-烯腈. With a topological polar surface area (TPSA) of 35.8 Ų, 2-(叔丁氨基)-3-甲基丁-2-烯腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(叔丁氨基)-3-甲基丁-2-烯腈 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 2-(叔丁氨基)-3-甲基丁-2-烯腈?
The CAS number of 2-(叔丁氨基)-3-甲基丁-2-烯腈 is 63364-14-7.
What is the molecular formula of 2-(叔丁氨基)-3-甲基丁-2-烯腈?
The molecular formula of 2-(叔丁氨基)-3-甲基丁-2-烯腈 is C9H16N2.
What is the molecular weight of 2-(叔丁氨基)-3-甲基丁-2-烯腈?
The molecular weight of 2-(叔丁氨基)-3-甲基丁-2-烯腈 is 152.13 g/mol.
Where can I buy 2-(叔丁氨基)-3-甲基丁-2-烯腈?
You can request a quote for 2-(叔丁氨基)-3-甲基丁-2-烯腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(叔丁氨基)-3-甲基丁-2-烯腈?
Yes, KEHONG BIO provides custom synthesis services for 2-(叔丁氨基)-3-甲基丁-2-烯腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.