(2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid
TL;DR: (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid (CAS 308339-67-5) is a chemical compound with molecular formula C12H10O3 and molecular weight 202.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic acid
Also Known As: J1.352.395I, (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid, (1,2,3,4-Tetrahydro-1-oxo-2-naphthalenylidene)-acetic acid, (2E)-(1-oxo-3,4-dihydro-2(1H)-naphthalenylidene)ethanoic acid, [(E)-1-Oxo-1,2,3,4-tetrahydronaphthalene-2-ylidene]acetic acid
| Molecular Formula | C12H10O3 |
|---|---|
| Molecular Weight | 202.06 g/mol |
| LogP | 1.8265 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.06299 |
| Heavy Atoms | 15 |
| Complexity | 457.68997 |
Chemical Identifiers
| CAS Number | 308339-67-5 |
|---|---|
| SMILES | C1C/C(=C\C(=O)O)/C(=O)C2=CC=CC=C21 |
Product Overview
(2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid (CAS 308339-67-5), with molecular formula C12H10O3 and molecular weight 202.06 g/mol. IUPAC: (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic acid.
Chemical Property Profile of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid
Property Insights of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid
The XLogP value of 1.8265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid. With a topological polar surface area (TPSA) of 54.37 Ų, (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid 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 (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid?
The CAS number of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid is 308339-67-5.
What is the molecular formula of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid?
The molecular formula of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid is C12H10O3.
What is the molecular weight of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid?
The molecular weight of (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid is 202.06 g/mol.
Where can I buy (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid?
You can request a quote for (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(1-oxo-3,4-dihydronaphthalen-2-ylidene)acetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.