Benzaldehyde, 3-(chloromethyl)-4-hydroxy-
TL;DR: Benzaldehyde, 3-(chloromethyl)-4-hydroxy- (CAS 53412-47-8) is a chemical compound with molecular formula C8H7ClO2 and molecular weight 170.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)-4-hydroxybenzaldehyde
Also Known As: 3-(chloromethyl)-4-hydroxybenzaldehyde, Benzaldehyde, 3-(chloromethyl)-4-hydroxy-, 3-Chlormethyl-4-hydroxybenzaldehyd, 4-Hydroxy-3-Chloromethylbenzaldehyde, 3-chloromethyl-4-hydroxy-benzaldehyde
| Molecular Formula | C8H7ClO2 |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | 1.9435 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.01346 |
| Heavy Atoms | 11 |
| Complexity | 270.79462 |
Chemical Identifiers
| CAS Number | 53412-47-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=O)CCl)O |
Product Overview
Benzaldehyde, 3-(chloromethyl)-4-hydroxy- (CAS 53412-47-8), with molecular formula C8H7ClO2 and molecular weight 170.01 g/mol. IUPAC: 3-(chloromethyl)-4-hydroxybenzaldehyde.
Chemical Property Profile of Benzaldehyde, 3-(chloromethyl)-4-hydroxy-
Property Insights of Benzaldehyde, 3-(chloromethyl)-4-hydroxy-
The XLogP value of 1.9435 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzaldehyde, 3-(chloromethyl)-4-hydroxy-. With a topological polar surface area (TPSA) of 37.3 Ų, Benzaldehyde, 3-(chloromethyl)-4-hydroxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzaldehyde, 3-(chloromethyl)-4-hydroxy- 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 Benzaldehyde, 3-(chloromethyl)-4-hydroxy-?
The CAS number of Benzaldehyde, 3-(chloromethyl)-4-hydroxy- is 53412-47-8.
What is the molecular formula of Benzaldehyde, 3-(chloromethyl)-4-hydroxy-?
The molecular formula of Benzaldehyde, 3-(chloromethyl)-4-hydroxy- is C8H7ClO2.
What is the molecular weight of Benzaldehyde, 3-(chloromethyl)-4-hydroxy-?
The molecular weight of Benzaldehyde, 3-(chloromethyl)-4-hydroxy- is 170.01 g/mol.
Where can I buy Benzaldehyde, 3-(chloromethyl)-4-hydroxy-?
You can request a quote for Benzaldehyde, 3-(chloromethyl)-4-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, 3-(chloromethyl)-4-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 3-(chloromethyl)-4-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.