3-Methyl-3-phenyloxirane-2-carboximidic acid
TL;DR: 3-Methyl-3-phenyloxirane-2-carboximidic acid (CAS 24446-48-8) is a chemical compound with molecular formula C10H11NO2 and molecular weight 177.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-3-phenyloxirane-2-carboxamide
Also Known As: 2,3-Epoxy-3-phenylbutyramide, 3-methyl-3-phenyloxirane-2-carboxamide, Butyramide,3-epoxy-3-phenyl-, BUTYRAMIDE, 2,3-EPOXY-3-PHENYL-, 2,3-epoxy-3-phenyl-butyric acid amide
| Molecular Formula | C10H11NO2 |
|---|---|
| Molecular Weight | 177.08 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.07898 |
| Heavy Atoms | 13 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 24446-48-8 |
|---|---|
| SMILES | CC1(C(O1)C(=O)N)C2=CC=CC=C2 |
| InChIKey | GPGCVLMDAHRNJI-UHFFFAOYSA-N |
Product Overview
3-Methyl-3-phenyloxirane-2-carboximidic acid (CAS 24446-48-8), with molecular formula C10H11NO2 and molecular weight 177.08 g/mol. IUPAC: 3-methyl-3-phenyloxirane-2-carboxamide.
Chemical Property Profile of 3-Methyl-3-phenyloxirane-2-carboximidic acid
Property Insights of 3-Methyl-3-phenyloxirane-2-carboximidic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-3-phenyloxirane-2-carboximidic acid. With a topological polar surface area (TPSA) of 55.6 Ų, 3-Methyl-3-phenyloxirane-2-carboximidic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-3-phenyloxirane-2-carboximidic acid has 1 hydrogen bond donor(s) and 2 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 3-Methyl-3-phenyloxirane-2-carboximidic acid?
The CAS number of 3-Methyl-3-phenyloxirane-2-carboximidic acid is 24446-48-8.
What is the molecular formula of 3-Methyl-3-phenyloxirane-2-carboximidic acid?
The molecular formula of 3-Methyl-3-phenyloxirane-2-carboximidic acid is C10H11NO2.
What is the molecular weight of 3-Methyl-3-phenyloxirane-2-carboximidic acid?
The molecular weight of 3-Methyl-3-phenyloxirane-2-carboximidic acid is 177.08 g/mol.
Where can I buy 3-Methyl-3-phenyloxirane-2-carboximidic acid?
You can request a quote for 3-Methyl-3-phenyloxirane-2-carboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-3-phenyloxirane-2-carboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-3-phenyloxirane-2-carboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.