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HT (chemical warfare agent) structure
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HT (chemical warfare agent)

TL;DR: HT (chemical warfare agent) (CAS 172672-28-5) is a chemical compound with molecular formula C12H24Cl4OS3 and molecular weight 419.97433 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-chloro-2-(2-chloroethylsulfanyl)ethane;1-(2-chloroethylsulfanyl)-2-[2-(2-chloroethylsulfanyl)ethoxy]ethane

Also Known As: Mustard/T, Sulfur mustard agent HT, HT (chemical warfare agent), Sr 59768, Ethane, 1,1'-thiobis(2-chloro-, mixted with 1,1'-oxybis(2-((2-chloroethyl)thio)ethane

CAS Number
172672-28-5
Molecular Formula
C12H24Cl4OS3
Molecular Weight
419.97433 g/mol
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Technical Specifications

Molecular FormulaC12H24Cl4OS3
Molecular Weight419.97433 g/mol
XLogP5.14
Topological Polar Surface Area (TPSA)85.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds14
Exact Mass421.9714 Da
Heavy Atoms20
Complexity115.0
SMILESC(CSCCCl)OCCSCCCl.C(CCl)SCCCl
InChIKeyNGNKKCMDHYWEDP-UHFFFAOYSA-N

Chemical Property Profile of HT (chemical warfare agent)

XLogP
5.14
TPSA (Topological Polar Surface Area)
85.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
14
Heavy Atoms
20
Complexity
115.0
Exact Mass
421.9714
Monoisotopic Mass
419.97433
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 HT (chemical warfare agent)

The XLogP value of 5.14 indicates that HT (chemical warfare agent) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for HT (chemical warfare agent). Following Lipinski's Rule of Five, HT (chemical warfare agent) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of HT (chemical warfare agent)?

The CAS number of HT (chemical warfare agent) is 172672-28-5.

What is the molecular formula of HT (chemical warfare agent)?

The molecular formula of HT (chemical warfare agent) is C12H24Cl4OS3.

What is the molecular weight of HT (chemical warfare agent)?

The molecular weight of HT (chemical warfare agent) is 419.97433 g/mol.

Where can I buy HT (chemical warfare agent)?

You can request a quote for HT (chemical warfare agent) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for HT (chemical warfare agent)?

Yes, CoreyChem provides custom synthesis services for HT (chemical warfare agent) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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