2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone
TL;DR: 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone (CAS 15121-83-2) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(hydroxymethyl)-3,4-dihydronaphthalen-1-one
Also Known As: Bionet2_000226, 2,2-bis(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-1-one, 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone, 2,2-bis(hydroxymethyl)-3,4-dihydronaphthalen-1-one, 2,2-bis(hydroxymethyl)tetralin-1-one
| Molecular Formula | C12H14O3 |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 0.7865 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.0943 |
| Heavy Atoms | 15 |
| Complexity | 380.20856 |
Chemical Identifiers
| CAS Number | 15121-83-2 |
|---|---|
| SMILES | C1CC(C(=O)C2=CC=CC=C21)(CO)CO |
Product Overview
2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone (CAS 15121-83-2), with molecular formula C12H14O3 and molecular weight 206.09 g/mol. IUPAC: 2,2-bis(hydroxymethyl)-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone
Property Insights of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone
The XLogP value of 0.7865 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone. With a topological polar surface area (TPSA) of 57.53 Ų, 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone has 2 hydrogen bond donor(s) and 3 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 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone?
The CAS number of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone is 15121-83-2.
What is the molecular formula of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone?
The molecular formula of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone is C12H14O3.
What is the molecular weight of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone?
The molecular weight of 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone is 206.09 g/mol.
Where can I buy 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone?
You can request a quote for 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone?
Yes, KEHONG BIO provides custom synthesis services for 2,2-bis(hydroxymethyl)-3,4-dihydro-1(2H)-naphthalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.