4-氨基-3-甲基苯甲酸
TL;DR: 4-氨基-3-甲基苯甲酸 (CAS 2486-70-6) is a chemical compound with molecular formula C8H9NO2 and molecular weight 151.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氨基-3-甲基苯甲酸
4-amino-3-methylbenzoic acid
Also Known As: 4-Amino-3-methylbenzoic acid, 3-methyl-4-aminobenzoic acid, 4-Amino-m-toluic acid, Benzoic acid, 4-amino-3-methyl-, Not Available
| Molecular Formula | C8H9NO2 |
|---|---|
| Molecular Weight | 151.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 151.06332 |
| Heavy Atoms | 11 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 2486-70-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)O)N |
| InChIKey | NHFKECPTBZZFBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氨基-3-甲基苯甲酸 (CAS 2486-70-6), with molecular formula C8H9NO2 and molecular weight 151.06 g/mol. IUPAC: 4-amino-3-methylbenzoic acid.
Chemical Property Profile of 4-氨基-3-甲基苯甲酸
Property Insights of 4-氨基-3-甲基苯甲酸
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氨基-3-甲基苯甲酸. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氨基-3-甲基苯甲酸. Following Lipinski's Rule of Five, 4-氨基-3-甲基苯甲酸 has 2 hydrogen bond donor(s) and 3 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 4-氨基-3-甲基苯甲酸?
The CAS number of 4-氨基-3-甲基苯甲酸 is 2486-70-6.
What is the molecular formula of 4-氨基-3-甲基苯甲酸?
The molecular formula of 4-氨基-3-甲基苯甲酸 is C8H9NO2.
What is the molecular weight of 4-氨基-3-甲基苯甲酸?
The molecular weight of 4-氨基-3-甲基苯甲酸 is 151.06 g/mol.
Where can I buy 4-氨基-3-甲基苯甲酸?
You can request a quote for 4-氨基-3-甲基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氨基-3-甲基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氨基-3-甲基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.