3-Heptyne, 7-iodo-2,2-dimethyl-
TL;DR: 3-Heptyne, 7-iodo-2,2-dimethyl- (CAS 55402-07-8) is a chemical compound with molecular formula C9H15I and molecular weight 250.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-iodo-2,2-dimethylhept-3-yne
Also Known As: 7-iodo-2,2-dimethylhept-3-yne, 2,2-Dimethyl-7-iodo-3-heptyne, 3-Heptyne, 7-iodo-2,2-dimethyl-, 7-Iodo-2,2-dimethyl-3-heptyne, 7-Iodo-2,2-dimethyl-3-heptyne #
| Molecular Formula | C9H15I |
|---|---|
| Molecular Weight | 250.02 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.02185 |
| Heavy Atoms | 10 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 55402-07-8 |
|---|---|
| SMILES | CC(C)(C)C#CCCCI |
| InChIKey | URVWEBDDUHPYFP-UHFFFAOYSA-N |
Product Overview
3-Heptyne, 7-iodo-2,2-dimethyl- (CAS 55402-07-8), with molecular formula C9H15I and molecular weight 250.02 g/mol. IUPAC: 7-iodo-2,2-dimethylhept-3-yne.
Chemical Property Profile of 3-Heptyne, 7-iodo-2,2-dimethyl-
Property Insights of 3-Heptyne, 7-iodo-2,2-dimethyl-
The XLogP value of 4.5 indicates that 3-Heptyne, 7-iodo-2,2-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Heptyne, 7-iodo-2,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptyne, 7-iodo-2,2-dimethyl- has 0 hydrogen bond donor(s) and 0 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 3-Heptyne, 7-iodo-2,2-dimethyl-?
The CAS number of 3-Heptyne, 7-iodo-2,2-dimethyl- is 55402-07-8.
What is the molecular formula of 3-Heptyne, 7-iodo-2,2-dimethyl-?
The molecular formula of 3-Heptyne, 7-iodo-2,2-dimethyl- is C9H15I.
What is the molecular weight of 3-Heptyne, 7-iodo-2,2-dimethyl-?
The molecular weight of 3-Heptyne, 7-iodo-2,2-dimethyl- is 250.02 g/mol.
Where can I buy 3-Heptyne, 7-iodo-2,2-dimethyl-?
You can request a quote for 3-Heptyne, 7-iodo-2,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Heptyne, 7-iodo-2,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Heptyne, 7-iodo-2,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.