2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-
TL;DR: 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- (CAS 40027-50-7) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N,N-bis(oxiran-2-ylmethyl)aniline
Also Known As: Diglycidyl-o-toluidine, N,N-Diglycidyl-o-toluidine, 2-methyl-N,N-bis(oxiran-2-ylmethyl)aniline, Oxiranemethanamine, N-(2-methylphenyl)-N-(oxiranylmethyl)-, N,N-Diglycidyl-2-methylbenzenamine
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 28.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 40027-50-7 |
|---|---|
| SMILES | CC1=CC=CC=C1N(CC2CO2)CC3CO3 |
| InChIKey | OVEUFHOBGCSKSH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- (CAS 40027-50-7), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 2-methyl-N,N-bis(oxiran-2-ylmethyl)aniline.
Chemical Property Profile of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-
Property Insights of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-. With a topological polar surface area (TPSA) of 28.3 Ų, 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- has 0 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 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-?
The CAS number of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- is 40027-50-7.
What is the molecular formula of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-?
The molecular formula of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- is C13H17NO2.
What is the molecular weight of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-?
The molecular weight of 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- is 219.13 g/mol.
Where can I buy 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-?
You can request a quote for 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxiranemethanamine, N-(2-methylphenyl)-N-(2-oxiranylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.