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Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- structure
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Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-

TL;DR: Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- (CAS 13906-82-6) is a chemical compound with molecular formula C10H12Cl2O and molecular weight 218.02652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,3-dichloropropan-2-yloxymethylbenzene

Also Known As: 2-benzyloxy-1,3-dichloropropane, 2-benzyloxy-1,3-dichloro-propane, 1,3-dichloropropan-2-yloxymethylbenzene, Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-, (((1,3-dichloropropan-2-yl)oxy)methyl)benzene

CAS Number
13906-82-6
Molecular Formula
C10H12Cl2O
Molecular Weight
218.02652 g/mol
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Technical Specifications

Molecular FormulaC10H12Cl2O
Molecular Weight218.02652 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)9.2 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds5
Exact Mass218.02652 Da
Heavy Atoms13
Complexity120.0
SMILESC1=CC=C(C=C1)COC(CCl)CCl
InChIKeyPSXZILDFNHACKW-UHFFFAOYSA-N

Chemical Property Profile of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-

XLogP
2.8
TPSA (Topological Polar Surface Area)
9.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
5
Heavy Atoms
13
Complexity
120.0
Exact Mass
218.02652
Monoisotopic Mass
218.02652
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-. With a topological polar surface area (TPSA) of 9.2 Ų, Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-?

The CAS number of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- is 13906-82-6.

What is the molecular formula of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-?

The molecular formula of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- is C10H12Cl2O.

What is the molecular weight of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-?

The molecular weight of Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- is 218.02652 g/mol.

Where can I buy Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-?

You can request a quote for Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]-?

Yes, CoreyChem provides custom synthesis services for Benzene, [[2-chloro-1-(chloromethyl)ethoxy]methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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