12-(9-蒽甲酰基)硬脂酸
TL;DR: 12-(9-蒽甲酰基)硬脂酸 (CAS 37469-99-1) is a chemical compound with molecular formula C33H44O3 and molecular weight 488.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(9-蒽甲酰基)硬脂酸
12-(anthracene-9-carbonyl)octadecanoic acid
Also Known As: Anthroylstearic acid, 12- stearicacid, 12-(9-Anthroyl)stearic acid, 12-(anthracene-9-carbonyl)octadecanoic acid, 9-Anthracenetridecanoic acid, .lambda.-hexyl-mu-oxo-
| Molecular Formula | C33H44O3 |
|---|---|
| Molecular Weight | 488.33 g/mol |
| LogP | 11.1 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 488.32904 |
| Heavy Atoms | 36 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 37469-99-1 |
|---|---|
| SMILES | CCCCCCC(CCCCCCCCCCC(=O)O)C(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31 |
| InChIKey | JMMLWELOFXAQEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
12-(9-蒽甲酰基)硬脂酸 (CAS 37469-99-1), with molecular formula C33H44O3 and molecular weight 488.33 g/mol. IUPAC: 12-(anthracene-9-carbonyl)octadecanoic acid.
Chemical Property Profile of 12-(9-蒽甲酰基)硬脂酸
Property Insights of 12-(9-蒽甲酰基)硬脂酸
The XLogP value of 11.1 indicates that 12-(9-蒽甲酰基)硬脂酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 12-(9-蒽甲酰基)硬脂酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-(9-蒽甲酰基)硬脂酸 has 1 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 12-(9-蒽甲酰基)硬脂酸?
The CAS number of 12-(9-蒽甲酰基)硬脂酸 is 37469-99-1.
What is the molecular formula of 12-(9-蒽甲酰基)硬脂酸?
The molecular formula of 12-(9-蒽甲酰基)硬脂酸 is C33H44O3.
What is the molecular weight of 12-(9-蒽甲酰基)硬脂酸?
The molecular weight of 12-(9-蒽甲酰基)硬脂酸 is 488.33 g/mol.
Where can I buy 12-(9-蒽甲酰基)硬脂酸?
You can request a quote for 12-(9-蒽甲酰基)硬脂酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-(9-蒽甲酰基)硬脂酸?
Yes, KEHONG BIO provides custom synthesis services for 12-(9-蒽甲酰基)硬脂酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.