Prop-2-enyl N-(4-hydroxybutyl)carbamate
TL;DR: Prop-2-enyl N-(4-hydroxybutyl)carbamate (CAS 339994-87-5) is a chemical compound with molecular formula C8H15NO3 and molecular weight 173.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl N-(4-hydroxybutyl)carbamate
Also Known As: Prop-2-enyl N-(4-hydroxybutyl)carbamate, 4-(Allyloxycarbonylamino)-1-butanol, Allyl N-(4-hydroxybutyl)carbamate, Prop-2-en-1-yl (4-hydroxybutyl)carbamate, (4-Hydroxybutyl)-carbamic acid allyl ester
| Molecular Formula | C8H15NO3 |
|---|---|
| Molecular Weight | 173.11 g/mol |
| LogP | 0.6711 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 173.1052 |
| Heavy Atoms | 12 |
| Complexity | 136.26466 |
Chemical Identifiers
| CAS Number | 339994-87-5 |
|---|---|
| SMILES | C=CCOC(=O)NCCCCO |
Product Overview
Prop-2-enyl N-(4-hydroxybutyl)carbamate (CAS 339994-87-5), with molecular formula C8H15NO3 and molecular weight 173.11 g/mol. IUPAC: prop-2-enyl N-(4-hydroxybutyl)carbamate.
Chemical Property Profile of Prop-2-enyl N-(4-hydroxybutyl)carbamate
Property Insights of Prop-2-enyl N-(4-hydroxybutyl)carbamate
The XLogP value of 0.6711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prop-2-enyl N-(4-hydroxybutyl)carbamate. With a topological polar surface area (TPSA) of 58.56 Ų, Prop-2-enyl N-(4-hydroxybutyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Prop-2-enyl N-(4-hydroxybutyl)carbamate has 2 hydrogen bond donor(s) and 3 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 Prop-2-enyl N-(4-hydroxybutyl)carbamate?
The CAS number of Prop-2-enyl N-(4-hydroxybutyl)carbamate is 339994-87-5.
What is the molecular formula of Prop-2-enyl N-(4-hydroxybutyl)carbamate?
The molecular formula of Prop-2-enyl N-(4-hydroxybutyl)carbamate is C8H15NO3.
What is the molecular weight of Prop-2-enyl N-(4-hydroxybutyl)carbamate?
The molecular weight of Prop-2-enyl N-(4-hydroxybutyl)carbamate is 173.11 g/mol.
Where can I buy Prop-2-enyl N-(4-hydroxybutyl)carbamate?
You can request a quote for Prop-2-enyl N-(4-hydroxybutyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prop-2-enyl N-(4-hydroxybutyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Prop-2-enyl N-(4-hydroxybutyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.