![2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate structure](/static/products/1708/170899-08-8.webp)
2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate
TL;DR: 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate (CAS 170899-08-8) is a chemical compound with molecular formula C10H16NO4- and molecular weight 214.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoate
Also Known As: Boc-D-Allylglycine, (2R)-2-(tert-butoxycarbonylamino)pent-4-enoate, 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate, (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoate, (2R)-2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate
| Molecular Formula | C10H16NO4- |
|---|---|
| Molecular Weight | 214.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.10793 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 170899-08-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H](CC=C)C(=O)[O-] |
| InChIKey | BUPDPLXLAKNJMI-SSDOTTSWSA-M |
Product Overview
2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate (CAS 170899-08-8), with molecular formula C10H16NO4- and molecular weight 214.11 g/mol. IUPAC: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoate.
Chemical Property Profile of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate
Property Insights of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate. Following Lipinski's Rule of Five, 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate has 1 hydrogen bond donor(s) and 4 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-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate?
The CAS number of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate is 170899-08-8.
What is the molecular formula of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate?
The molecular formula of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate is C10H16NO4-.
What is the molecular weight of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate?
The molecular weight of 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate is 214.11 g/mol.
Where can I buy 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate?
You can request a quote for 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-{[tert-Butoxy(hydroxy)methylidene]amino}pent-4-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.