methyl N-((4-aminophenyl)methyl)carbamate
TL;DR: methyl N-((4-aminophenyl)methyl)carbamate (CAS 10252-00-3) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-[(4-aminophenyl)methyl]carbamate
Also Known As: Methyl N-[(4-aminophenyl)methyl]carbamate, methyl 4-aminobenzylcarbamate, (4-Aminobenzyl)carbamic acid methyl ester, MethylN-[(4-aminophenyl)methyl]carbamate, methyl N-((4-aminophenyl)methyl)carbamate
Technical Specifications
| Molecular Formula | C9H12N2O2 |
| Molecular Weight | 180.08987 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.08987 Da |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
| SMILES | COC(=O)NCC1=CC=C(C=C1)N |
| InChIKey | MFQVSXFZFMRDFR-UHFFFAOYSA-N |
Chemical Property Profile of methyl N-((4-aminophenyl)methyl)carbamate
Property Insights of methyl N-((4-aminophenyl)methyl)carbamate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-((4-aminophenyl)methyl)carbamate. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-((4-aminophenyl)methyl)carbamate. Following Lipinski's Rule of Five, methyl N-((4-aminophenyl)methyl)carbamate 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
What is the CAS number of methyl N-((4-aminophenyl)methyl)carbamate?
The CAS number of methyl N-((4-aminophenyl)methyl)carbamate is 10252-00-3.
What is the molecular formula of methyl N-((4-aminophenyl)methyl)carbamate?
The molecular formula of methyl N-((4-aminophenyl)methyl)carbamate is C9H12N2O2.
What is the molecular weight of methyl N-((4-aminophenyl)methyl)carbamate?
The molecular weight of methyl N-((4-aminophenyl)methyl)carbamate is 180.08987 g/mol.
Where can I buy methyl N-((4-aminophenyl)methyl)carbamate?
You can request a quote for methyl N-((4-aminophenyl)methyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-((4-aminophenyl)methyl)carbamate?
Yes, CoreyChem provides custom synthesis services for methyl N-((4-aminophenyl)methyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.