5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-
TL;DR: 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- (CAS 63247-28-9) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxo-6-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaenyl)propanoic acid
Also Known As: 2-(5H-Dibenzo(a,d)cyclohepten-5-one)-2-propionic acid, 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-, 2-(5-Oxo-5H-dibenzo[a,d]cyclohepten-2-yl)-propionic acid, 5H-dibenzo[a,d]cyclohepten-5-on-2-yl propionic acid, (5-oxo-5H-dibenzo[a,d]cyclohepten-2yl)-propionic acid
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 63247-28-9 |
|---|---|
| SMILES | CC(C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C=C2)C(=O)O |
| InChIKey | CYCCNOGIPSEDOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- (CAS 63247-28-9), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: 2-(2-oxo-6-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaenyl)propanoic acid.
Chemical Property Profile of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-
Property Insights of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-
The XLogP value of 3.9 indicates that 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- has 1 hydrogen bond donor(s) and 3 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 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-?
The CAS number of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- is 63247-28-9.
What is the molecular formula of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-?
The molecular formula of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- is C18H14O3.
What is the molecular weight of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-?
The molecular weight of 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- is 278.09 g/mol.
Where can I buy 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-?
You can request a quote for 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenzo(a,d)cycloheptene-2-acetic acid, alpha-methyl-5-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.