Heptane, 1,7-difluoro-
TL;DR: Heptane, 1,7-difluoro- (CAS 693-46-9) is a chemical compound with molecular formula C7H14F2 and molecular weight 136.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,7-difluoroheptane
Also Known As: 1,7-Difluoroheptane, HEPTANE, 1,7-DIFLUORO-, BRN 3042530, RefChem:347224
| Molecular Formula | C7H14F2 |
|---|---|
| Molecular Weight | 136.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 136.10635 |
| Heavy Atoms | 9 |
| Complexity | 40.0 |
Chemical Identifiers
| CAS Number | 693-46-9 |
|---|---|
| SMILES | C(CCCF)CCCF |
| InChIKey | ZWXJTBZOZHXIAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptane, 1,7-difluoro- (CAS 693-46-9), with molecular formula C7H14F2 and molecular weight 136.11 g/mol. IUPAC: 1,7-difluoroheptane.
Chemical Property Profile of Heptane, 1,7-difluoro-
Property Insights of Heptane, 1,7-difluoro-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptane, 1,7-difluoro-. With a topological polar surface area (TPSA) of 0.0 Ų, Heptane, 1,7-difluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptane, 1,7-difluoro- 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 Heptane, 1,7-difluoro-?
The CAS number of Heptane, 1,7-difluoro- is 693-46-9.
What is the molecular formula of Heptane, 1,7-difluoro-?
The molecular formula of Heptane, 1,7-difluoro- is C7H14F2.
What is the molecular weight of Heptane, 1,7-difluoro-?
The molecular weight of Heptane, 1,7-difluoro- is 136.11 g/mol.
Where can I buy Heptane, 1,7-difluoro-?
You can request a quote for Heptane, 1,7-difluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptane, 1,7-difluoro-?
Yes, KEHONG BIO provides custom synthesis services for Heptane, 1,7-difluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.