9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-
TL;DR: 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- (CAS 34037-46-2) is a chemical compound with molecular formula C21H14BrNO2 and molecular weight 391.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-1-(4-methylanilino)anthracene-9,10-dione
Also Known As: METHYL 4-(CHLOROMETHYL)BENZOATE, 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-, 3-bromo-1-(4-methylanilino)anthracene-9,10-dione, 1-((4-Methylphenyl)amino)-3-bromo-9,10-anthracenedione, 9,10-Anthracenedione, 3-bromo-1-[(4-methylphenyl)amino]-
| Molecular Formula | C21H14BrNO2 |
|---|---|
| Molecular Weight | 391.02 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 391.02078 |
| Heavy Atoms | 25 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 34037-46-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=CC(=CC3=C2C(=O)C4=CC=CC=C4C3=O)Br |
| InChIKey | CJCDAMKVDXTWCY-UHFFFAOYSA-N |
Product Overview
9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- (CAS 34037-46-2), with molecular formula C21H14BrNO2 and molecular weight 391.02 g/mol. IUPAC: 3-bromo-1-(4-methylanilino)anthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-
Property Insights of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-
The XLogP value of 6.0 indicates that 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- 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 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-?
The CAS number of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- is 34037-46-2.
What is the molecular formula of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-?
The molecular formula of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- is C21H14BrNO2.
What is the molecular weight of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-?
The molecular weight of 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- is 391.02 g/mol.
Where can I buy 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-?
You can request a quote for 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1-((4-methylphenyl)amino)-3-bromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.