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8,9-二氢-7H-苯并[7]环辛烯-5-甲酸
TL;DR: 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 (CAS 14378-58-6) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9-二氢-7H-苯并[7]环辛烯-5-甲酸
8,9-dihydro-7H-benzo[7]annulene-5-carboxylic acid
Also Known As: 8,9-dihydro-7H-benzo[7]annulene-5-carboxylic acid, 6,7-Dihydro-5H-benzocycloheptene-9-carboxylic acid, 6,7-dihydro-5H-benzo[a]cycloheptene-9-carboxylic acid, 6,7-dihydro-5h-benzo[7]annulene-9-carboxylic acid, AN-975/13809001
| Molecular Formula | C12H12O2 |
|---|---|
| Molecular Weight | 188.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.08372 |
| Heavy Atoms | 14 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 14378-58-6 |
|---|---|
| SMILES | C1CC=C(C2=CC=CC=C2C1)C(=O)O |
| InChIKey | ZHJATQRAAIHJIH-UHFFFAOYSA-N |
Product Overview
8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 (CAS 14378-58-6), with molecular formula C12H12O2 and molecular weight 188.08 g/mol. IUPAC: 8,9-dihydro-7H-benzo[7]annulene-5-carboxylic acid.
Chemical Property Profile of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸
Property Insights of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸. With a topological polar surface area (TPSA) of 37.3 Ų, 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 has 1 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 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸?
The CAS number of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 is 14378-58-6.
What is the molecular formula of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸?
The molecular formula of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 is C12H12O2.
What is the molecular weight of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸?
The molecular weight of 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 is 188.08 g/mol.
Where can I buy 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸?
You can request a quote for 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 8,9-二氢-7H-苯并[7]环辛烯-5-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.