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[1-(3-Methylphenyl)pyrazol-4-yl]methanamine
TL;DR: [1-(3-Methylphenyl)pyrazol-4-yl]methanamine (CAS 400876-68-8) is a chemical compound with molecular formula C11H13N3 and molecular weight 187.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(3-methylphenyl)pyrazol-4-yl]methanamine
Also Known As: (1-(m-Tolyl)-1H-pyrazol-4-yl)methanamine, [1-(3-methylphenyl)pyrazol-4-yl]methanamine, [1-(3-methylphenyl)-1H-pyrazol-4-yl]methylamine, (1-m-tolyl-1H-pyrazol-4-yl)methanamine, 1-[1-(3-methylphenyl)-1H-pyrazol-4-yl]methanamine
| Molecular Formula | C11H13N3 |
|---|---|
| Molecular Weight | 187.11 g/mol |
| LogP | 1.63942 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.11095 |
| Heavy Atoms | 14 |
| Complexity | 431.60263 |
Chemical Identifiers
| CAS Number | 400876-68-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C=C(C=N2)CN |
Product Overview
[1-(3-Methylphenyl)pyrazol-4-yl]methanamine (CAS 400876-68-8), with molecular formula C11H13N3 and molecular weight 187.11 g/mol. IUPAC: [1-(3-methylphenyl)pyrazol-4-yl]methanamine.
Chemical Property Profile of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine
Property Insights of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine
The XLogP value of 1.63942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(3-Methylphenyl)pyrazol-4-yl]methanamine. With a topological polar surface area (TPSA) of 43.84 Ų, [1-(3-Methylphenyl)pyrazol-4-yl]methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(3-Methylphenyl)pyrazol-4-yl]methanamine 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 [1-(3-Methylphenyl)pyrazol-4-yl]methanamine?
The CAS number of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine is 400876-68-8.
What is the molecular formula of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine?
The molecular formula of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine is C11H13N3.
What is the molecular weight of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine?
The molecular weight of [1-(3-Methylphenyl)pyrazol-4-yl]methanamine is 187.11 g/mol.
Where can I buy [1-(3-Methylphenyl)pyrazol-4-yl]methanamine?
You can request a quote for [1-(3-Methylphenyl)pyrazol-4-yl]methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(3-Methylphenyl)pyrazol-4-yl]methanamine?
Yes, KEHONG BIO provides custom synthesis services for [1-(3-Methylphenyl)pyrazol-4-yl]methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.