4-(Ethylnitrosoamino)-1-butanol
TL;DR: 4-(Ethylnitrosoamino)-1-butanol (CAS 54897-62-0) is a chemical compound with molecular formula C6H14N2O2 and molecular weight 146.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-(4-hydroxybutyl)nitrous amide
Also Known As: N-Ethyl-n-butan-4-ol-nitrosamine, EHBN, N-Ethyl-N-(4-hydroxybutyl)nitrosamine, GERANIOL, N-ethyl-N-(4-hydroxybutyl)nitrous amide
| Molecular Formula | C6H14N2O2 |
|---|---|
| Molecular Weight | 146.11 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 146.10553 |
| Heavy Atoms | 10 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 54897-62-0 |
|---|---|
| SMILES | CCN(CCCCO)N=O |
| InChIKey | SAWPRHGGVOPPSR-UHFFFAOYSA-N |
Product Overview
4-(Ethylnitrosoamino)-1-butanol (CAS 54897-62-0), with molecular formula C6H14N2O2 and molecular weight 146.11 g/mol. IUPAC: N-ethyl-N-(4-hydroxybutyl)nitrous amide.
Chemical Property Profile of 4-(Ethylnitrosoamino)-1-butanol
Property Insights of 4-(Ethylnitrosoamino)-1-butanol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Ethylnitrosoamino)-1-butanol. With a topological polar surface area (TPSA) of 52.9 Ų, 4-(Ethylnitrosoamino)-1-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Ethylnitrosoamino)-1-butanol 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 4-(Ethylnitrosoamino)-1-butanol?
The CAS number of 4-(Ethylnitrosoamino)-1-butanol is 54897-62-0.
What is the molecular formula of 4-(Ethylnitrosoamino)-1-butanol?
The molecular formula of 4-(Ethylnitrosoamino)-1-butanol is C6H14N2O2.
What is the molecular weight of 4-(Ethylnitrosoamino)-1-butanol?
The molecular weight of 4-(Ethylnitrosoamino)-1-butanol is 146.11 g/mol.
Where can I buy 4-(Ethylnitrosoamino)-1-butanol?
You can request a quote for 4-(Ethylnitrosoamino)-1-butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Ethylnitrosoamino)-1-butanol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Ethylnitrosoamino)-1-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.