4-Amino-3-methylphenyl dimethyl phosphate
TL;DR: 4-Amino-3-methylphenyl dimethyl phosphate (CAS 58657-34-4) is a chemical compound with molecular formula C9H14NO4P and molecular weight 231.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-3-methylphenyl) dimethyl phosphate
Also Known As: 4-Amino-3-methylphenyl dimethyl phosphate, (4-amino-3-methylphenyl) dimethyl phosphate, Phosphoric acid, 4-amino-3-methylphenyl dimethyl ester
| Molecular Formula | C9H14NO4P |
|---|---|
| Molecular Weight | 231.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.06604 |
| Heavy Atoms | 15 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 58657-34-4 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OP(=O)(OC)OC)N |
| InChIKey | JHHNWOZLXWWJAL-UHFFFAOYSA-N |
Product Overview
4-Amino-3-methylphenyl dimethyl phosphate (CAS 58657-34-4), with molecular formula C9H14NO4P and molecular weight 231.07 g/mol. IUPAC: (4-amino-3-methylphenyl) dimethyl phosphate.
Chemical Property Profile of 4-Amino-3-methylphenyl dimethyl phosphate
Property Insights of 4-Amino-3-methylphenyl dimethyl phosphate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3-methylphenyl dimethyl phosphate. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-methylphenyl dimethyl phosphate. Following Lipinski's Rule of Five, 4-Amino-3-methylphenyl dimethyl phosphate has 1 hydrogen bond donor(s) and 5 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-Amino-3-methylphenyl dimethyl phosphate?
The CAS number of 4-Amino-3-methylphenyl dimethyl phosphate is 58657-34-4.
What is the molecular formula of 4-Amino-3-methylphenyl dimethyl phosphate?
The molecular formula of 4-Amino-3-methylphenyl dimethyl phosphate is C9H14NO4P.
What is the molecular weight of 4-Amino-3-methylphenyl dimethyl phosphate?
The molecular weight of 4-Amino-3-methylphenyl dimethyl phosphate is 231.07 g/mol.
Where can I buy 4-Amino-3-methylphenyl dimethyl phosphate?
You can request a quote for 4-Amino-3-methylphenyl dimethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-3-methylphenyl dimethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-3-methylphenyl dimethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.