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N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine
TL;DR: N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine (CAS 110841-68-4) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine
Also Known As: N-(3-METHOXYBENZYL)-2-PROPEN-1-AMINE, N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine, 95% +(stabilized with TBC), N-(3-Methoxybenzyl)prop-2-en-1-amine, [(3-methoxyphenyl)methyl](prop-2-en-1-yl)amine
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 1.9708 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 270.54773 |
Chemical Identifiers
| CAS Number | 110841-68-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CNCC=C |
Product Overview
N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine (CAS 110841-68-4), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine.
Chemical Property Profile of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine
Property Insights of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine
The XLogP value of 1.9708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine. With a topological polar surface area (TPSA) of 21.26 Ų, N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine 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 N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine?
The CAS number of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine is 110841-68-4.
What is the molecular formula of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine?
The molecular formula of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine is C11H15NO.
What is the molecular weight of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine?
The molecular weight of N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine is 177.12 g/mol.
Where can I buy N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine?
You can request a quote for N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-methoxyphenyl)methyl]prop-2-en-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.