Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester
TL;DR: Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester (CAS 67924-13-4) is a chemical compound with molecular formula C23H27NO2 and molecular weight 349.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2-benzylideneoctylideneamino)benzoate
Also Known As: JASMEA, Amylcinnamic aldehyde methylanthranilate (Schiff Base), Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester, Methyl 2-[[2-(phenylmethylene)octylidene]amino]benzoate, Benzoic acid, 2-[[2-(phenylmethylene)octylidene]amino]-, methyl ester
| Molecular Formula | C23H27NO2 |
|---|---|
| Molecular Weight | 349.20 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 349.2042 |
| Heavy Atoms | 26 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 67924-13-4 |
|---|---|
| SMILES | CCCCCCC(=CC1=CC=CC=C1)C=NC2=CC=CC=C2C(=O)OC |
| InChIKey | XTFDJRLNMKZPCR-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester (CAS 67924-13-4), with molecular formula C23H27NO2 and molecular weight 349.20 g/mol. IUPAC: methyl 2-(2-benzylideneoctylideneamino)benzoate.
Chemical Property Profile of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester
Property Insights of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester
The XLogP value of 6.5 indicates that Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester?
The CAS number of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester is 67924-13-4.
What is the molecular formula of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester?
The molecular formula of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester is C23H27NO2.
What is the molecular weight of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester?
The molecular weight of Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester is 349.20 g/mol.
Where can I buy Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester?
You can request a quote for Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((2-(phenylmethylene)octylidene)amino)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.