Benzenamine, 3-bromo-4-methyl-
TL;DR: Benzenamine, 3-bromo-4-methyl- (CAS 7745-91-7) is a chemical compound with molecular formula C7H8BrN and molecular weight 184.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-methylaniline
Also Known As: 3-Bromo-4-methylaniline, 3-Bromo-p-toluidine, p-Toluidine, 3-bromo-, 3-Bromo-1,4-toluidine, Benzenamine, 3-bromo-4-methyl-
| Molecular Formula | C7H8BrN |
|---|---|
| Molecular Weight | 184.98 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.98401 |
| Heavy Atoms | 9 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 7745-91-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N)Br |
| InChIKey | GRXMMIBZRMKADT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, 3-bromo-4-methyl- (CAS 7745-91-7), with molecular formula C7H8BrN and molecular weight 184.98 g/mol. IUPAC: 3-bromo-4-methylaniline.
Chemical Property Profile of Benzenamine, 3-bromo-4-methyl-
Property Insights of Benzenamine, 3-bromo-4-methyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 3-bromo-4-methyl-. With a topological polar surface area (TPSA) of 26.0 Ų, Benzenamine, 3-bromo-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 3-bromo-4-methyl- has 1 hydrogen bond donor(s) and 1 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 Benzenamine, 3-bromo-4-methyl-?
The CAS number of Benzenamine, 3-bromo-4-methyl- is 7745-91-7.
What is the molecular formula of Benzenamine, 3-bromo-4-methyl-?
The molecular formula of Benzenamine, 3-bromo-4-methyl- is C7H8BrN.
What is the molecular weight of Benzenamine, 3-bromo-4-methyl-?
The molecular weight of Benzenamine, 3-bromo-4-methyl- is 184.98 g/mol.
Where can I buy Benzenamine, 3-bromo-4-methyl-?
You can request a quote for Benzenamine, 3-bromo-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 3-bromo-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 3-bromo-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.