1-Decen-4-yne, 2-nitro-
TL;DR: 1-Decen-4-yne, 2-nitro- (CAS 80255-22-7) is a chemical compound with molecular formula C10H15NO2 and molecular weight 181.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrodec-1-en-4-yne
Also Known As: 2-Nitro-1-decen-4-yne, 2-nitrodec-1-en-4-yne, 1-Decen-4-yne, 2-nitro-, 2-Nitro-1-decen-4-yne #
| Molecular Formula | C10H15NO2 |
|---|---|
| Molecular Weight | 181.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.11028 |
| Heavy Atoms | 13 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 80255-22-7 |
|---|---|
| SMILES | CCCCCC#CCC(=C)[N+](=O)[O-] |
| InChIKey | GBVFXBQDNVRRLE-UHFFFAOYSA-N |
Product Overview
1-Decen-4-yne, 2-nitro- (CAS 80255-22-7), with molecular formula C10H15NO2 and molecular weight 181.11 g/mol. IUPAC: 2-nitrodec-1-en-4-yne.
Chemical Property Profile of 1-Decen-4-yne, 2-nitro-
Property Insights of 1-Decen-4-yne, 2-nitro-
The XLogP value of 3.8 indicates that 1-Decen-4-yne, 2-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Decen-4-yne, 2-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Decen-4-yne, 2-nitro- has 0 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 1-Decen-4-yne, 2-nitro-?
The CAS number of 1-Decen-4-yne, 2-nitro- is 80255-22-7.
What is the molecular formula of 1-Decen-4-yne, 2-nitro-?
The molecular formula of 1-Decen-4-yne, 2-nitro- is C10H15NO2.
What is the molecular weight of 1-Decen-4-yne, 2-nitro-?
The molecular weight of 1-Decen-4-yne, 2-nitro- is 181.11 g/mol.
Where can I buy 1-Decen-4-yne, 2-nitro-?
You can request a quote for 1-Decen-4-yne, 2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Decen-4-yne, 2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1-Decen-4-yne, 2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.