![3-[(Butylamino)methyl]phenol structure](/static/products/6050/60509-45-7.webp)
3-[(Butylamino)methyl]phenol
TL;DR: 3-[(Butylamino)methyl]phenol (CAS 60509-45-7) is a chemical compound with molecular formula C11H17NO and molecular weight 179.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(butylaminomethyl)phenol
Also Known As: 3-[(BUTYLAMINO)METHYL]PHENOL, 3-(butylaminomethyl)phenol, Phenol, 3-[(butylamino)methyl]-, 3-(butylamino)methylphenol, Phenol,3-[(butylamino)methyl]
| Molecular Formula | C11H17NO |
|---|---|
| Molecular Weight | 179.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 179.13101 |
| Heavy Atoms | 13 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 60509-45-7 |
|---|---|
| SMILES | CCCCNCC1=CC(=CC=C1)O |
| InChIKey | VGCHIRRBHSWAEM-UHFFFAOYSA-N |
Product Overview
3-[(Butylamino)methyl]phenol (CAS 60509-45-7), with molecular formula C11H17NO and molecular weight 179.13 g/mol. IUPAC: 3-(butylaminomethyl)phenol.
Chemical Property Profile of 3-[(Butylamino)methyl]phenol
Property Insights of 3-[(Butylamino)methyl]phenol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Butylamino)methyl]phenol. With a topological polar surface area (TPSA) of 32.3 Ų, 3-[(Butylamino)methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(Butylamino)methyl]phenol 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 3-[(Butylamino)methyl]phenol?
The CAS number of 3-[(Butylamino)methyl]phenol is 60509-45-7.
What is the molecular formula of 3-[(Butylamino)methyl]phenol?
The molecular formula of 3-[(Butylamino)methyl]phenol is C11H17NO.
What is the molecular weight of 3-[(Butylamino)methyl]phenol?
The molecular weight of 3-[(Butylamino)methyl]phenol is 179.13 g/mol.
Where can I buy 3-[(Butylamino)methyl]phenol?
You can request a quote for 3-[(Butylamino)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Butylamino)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Butylamino)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.