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Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-
TL;DR: Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- (CAS 33498-89-4) is a chemical compound with molecular formula C19H23ClO2 and molecular weight 318.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-chloro-2-(phenylmethoxymethyl)butoxy]methylbenzene
Also Known As: 2-2'-Chloroethyl-1,3-dibenzyloxypropane, Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-, ({2-[(benzyloxy)methyl]-4-chlorobutoxy}methyl)benzene, [4-chloro-2-(phenylmethoxymethyl)butoxy]methylbenzene, 1-(Benzyloxy)-2-[(benzyloxy)methyl]-4-chlorobutane
| Molecular Formula | C19H23ClO2 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 318.13867 |
| Heavy Atoms | 22 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 33498-89-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COCC(CCCl)COCC2=CC=CC=C2 |
| InChIKey | GLCBRZCICHUIFQ-UHFFFAOYSA-N |
Product Overview
Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- (CAS 33498-89-4), with molecular formula C19H23ClO2 and molecular weight 318.14 g/mol. IUPAC: [4-chloro-2-(phenylmethoxymethyl)butoxy]methylbenzene.
Chemical Property Profile of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-
Property Insights of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-
The XLogP value of 4.1 indicates that Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- has 0 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 Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-?
The CAS number of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- is 33498-89-4.
What is the molecular formula of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-?
The molecular formula of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- is C19H23ClO2.
What is the molecular weight of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-?
The molecular weight of Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- is 318.14 g/mol.
Where can I buy Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-?
You can request a quote for Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1-(benzyloxy)-2-[(benzyloxy)methyl]-4-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.