间甲苯甲酰肼
TL;DR: 间甲苯甲酰肼 (CAS 13050-47-0) is a chemical compound with molecular formula C8H10N2O and molecular weight 150.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
间甲苯甲酰肼
3-methylbenzohydrazide
Also Known As: 3-Methylbenzohydrazide, 3-Methylbenzoic hydrazide, m-Toluic acid hydrazide, 3-Methyl-benzoylhydrazide, m-Toluic hydrazide
| Molecular Formula | C8H10N2O |
|---|---|
| Molecular Weight | 150.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 150.07932 |
| Heavy Atoms | 11 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 13050-47-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NN |
| InChIKey | XFNNAMBYJSQXKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
间甲苯甲酰肼 (CAS 13050-47-0), with molecular formula C8H10N2O and molecular weight 150.08 g/mol. IUPAC: 3-methylbenzohydrazide.
Chemical Property Profile of 间甲苯甲酰肼
Property Insights of 间甲苯甲酰肼
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 间甲苯甲酰肼. With a topological polar surface area (TPSA) of 55.1 Ų, 间甲苯甲酰肼 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 间甲苯甲酰肼 has 2 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 间甲苯甲酰肼?
The CAS number of 间甲苯甲酰肼 is 13050-47-0.
What is the molecular formula of 间甲苯甲酰肼?
The molecular formula of 间甲苯甲酰肼 is C8H10N2O.
What is the molecular weight of 间甲苯甲酰肼?
The molecular weight of 间甲苯甲酰肼 is 150.08 g/mol.
Where can I buy 间甲苯甲酰肼?
You can request a quote for 间甲苯甲酰肼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间甲苯甲酰肼?
Yes, KEHONG BIO provides custom synthesis services for 间甲苯甲酰肼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.