Molecular Weight of Mustard gas (C4H8Cl2S)

Molecular Weight Description

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Additional Information for Identifying Mustard gas Molecule

• Structure Data File (SDF/MOL File) of Mustard gas

  The structure data file (SDF/MOL File) of Mustard gas is available for download in the SDF page of Mustard gas, which provides the information on atoms, bonds, connectivity and coordinates of Mustard gas. The Mustard gas structure data file can be imported to most of the chemistry-related software, providing three-dimensional visualization and further analysis.

• Chemical structure of Mustard gas

  The molecular structure image of Mustard gas is available in chemical structure page of Mustard gas, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Mustard gas and the chemical bonds that hold the atoms together.

• Chemical formula of Mustard gas

  The molecular formula of Mustard gas is given in chemical formula page of Mustard gas, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

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• InChI (IUPAC International Chemical Identifier) information of Mustard gas

  In addition to the molecular weight information, the structural information of Mustard gas in a textual expression is available via InChi. The full standard InChI of Mustard gas is given below:

  InChI=1S/C4H8Cl2S/c5-1-3-7-4-2-6/h1-4H2

  It can provide a way to encode the molecular information of Mustard gas to facilitate the search for the compound information in databases and on the web.

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of Mustard gas is:

  InChIKey=QKSKPIVNLNLAAV-UHFFFAOYSA-N

  It may allow easier web searches for Mustard gas. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Mustard gas as the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of Mustard gas

  There may be different names of the Mustard gas compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:

  • 69020-37-7
  • 68157-62-0
  • 39472-40-7
  • 172672-70-7
  • A828174
  • MUSTARD GAS [BIS-2-CHLOROETHYL SULFIDE]
  • 1-Chloro-2-[(2-chloroethyl)sulfanyl]ethane #
  • 1-chloranyl-2-(2-chloroethylsulfanyl)ethane
  • 1-Chloro-2-(.beta.-chloroethylthio)ethane
  • 1-chloro-2-(2-chloroethylsulfanyl)ethane

  • .beta.,.beta.'-Dichloroethyl sulfide
  • .beta.,.beta.-Dichloroethyl sulfide
  • beta, beta'-dichlorodiethyl sulfide
  • .beta.-Chloroethylisobutyl sulfide
  • Ethane,1,1'-thiobis[2-chloro-
  • beta,beta'-dichlorodiethyl sulfide
  • beta, beta'-dichloroethyl sulfide
  • Bis(.beta.-chloroethyl) sulfide
  • HD (chemical warfare agent)
  • Di(2-chloroethyl) sulfide

  • T8KEC9FH9P
  • Kampfstoff ''lost''
  • 2-chloroethylsulphide
  • Ethane, 1,1'-thiobis(2-chloro)-
  • Dichloroethyl sulfide
  • Mustard T- mixture
  • S Lost
  • Yellow Cro ss
  • Yellow Cross
  • Bis(beta-chloroethyl) sulfide

  • KampfstoffLost
  • C4H8Cl2S
  • Psoriazin
  • Mustardgas
  • Bis-(2-chloroethyl) Sulfide
  • 1-chloro-2-[(2-chloroethyl)thio]ethane
  • 1-chloro-2-(2-chloroethylthio)ethane
  • Dichloroethyl sulfide [Forbidden]
  • HD
  • 1-Chloro-2-(beta-chloroethylthio)ethane

  • bis-(2-chloroethyl)sulfide
  • bis(2-chloroethyl)sulfane
  • Ethane, 1,1'-thiobis(2-chloro-
  • BIS(2-CHLOROETHYL)SULFIDE
  • Diethyl sulfide, 2,2'-dichloro
  • beta,beta'-Dichloroethyl sulphide
  • beta,beta-Dichlor-ethyl-sulphide
  • beta,beta'-Dichloroethyl sulfide
  • 2,2'-Dichlorodiethyl sulphide
  • 2,2'-Dichloroethyl sulphide

  • Bis(beta-chloroethyl)sulphide
  • Bis(2-chloroethyl) sulphide
  • Bis(beta-chloroethyl)sulfide
  • Bis(2-chloroethyl)sulphide
  • Ethane, 1,1'-thiobis[2-chloro-
  • Di-2-chloroethyl sulphide
  • Mustard
  • 2,2'-Dichlorodiethyl sulfide
  • Sulfide, bis(2-chloroethyl)
  • 2,2'-Dichloroethyl sulfide

  • Sulphur mustard gas
  • Gelbkreuz [Czech]
  • Agent THD
  • Di-2-chloroethyl sulfide
  • Kampstoff lost
  • Agent hd
  • Dichlorodiethyl sulfide
  • Kampstoff lost
  • Sulphur mustard
  • Psoriasin

  • 1,1'-Thiobis(2-chloroethane)
  • Sulfur mustard gas
  • Mustard HD
  • Yellow cross gas
  • S Mustard
  • 505-60-2
  • S-yperite
  • Mustard vapor
  • Gelbkreuz
  • S-Lost

  • Bis(2-chloroethyl) sulfide
  • Distilled mustard
  • Mustard, sulfur
  • Schwefel-lost
  • Yellow cross liquid
  • Lost
  • Iprit
  • Senfgas
  • Yperite
  • Sulfur mustard

  • Mustard gas

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Mustard gas Identification Summary Frequently Asked Questions (FAQs)

What’s the formula of Mustard gas?
C4H8Cl2S
How many atoms and what are the elements in the Mustard gas molecule?
15 atom(s) - 8 Hydrogen atom(s), 4 Carbon atom(s), 1 Sulfur atom(s), and 2 Chlorine atom(s)
How many chemical bonds and what types of bonds are in the Mustard gas structure?
14 bond(s) - 6 non-H bond(s), 2 rotatable bond(s), and 1 sulfide(s)
What’s the molar mass of Mustard gas?
159.07672 g/mol
What’s the SMILES format of Mustard gas?
ClCCSCCCl
What’s the InChI format of Mustard gas?
InChI=1S/C4H8Cl2S/c5-1-3-7-4-2-6/h1-4H2
What’s the InChIKey string of Mustard gas?
QKSKPIVNLNLAAV-UHFFFAOYSA-N

2265 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).