Phenyl chlorodithioformate - CAS 16911-89-0

Name: Phenyl chlorodithioformate
Brand: BOC Sciences
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Catalog:	BB012520
Product Name:	Phenyl chlorodithioformate
CAS:	16911-89-0
Synonyms:	phenyl chloromethanedithioate

Technical Data

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Computed Properties

IUPAC Name:	phenyl chloromethanedithioate
Description:	Phenyl chlorodithioformate (CAS# 16911-89-0) is a useful research chemical.
Molecular Weight:	188.70
Molecular Formula:	C7H5ClS2
Canonical SMILES:	C1=CC=C(C=C1)SC(=S)Cl
InChI:	InChI=1S/C7H5ClS2/c8-7(9)10-6-4-2-1-3-5-6/h1-5H
InChI Key:	XEXIHCWFFNGQDE-UHFFFAOYSA-N
Boiling Point:	135 °C / 15 mmHg (lit.)
Density:	1.331 g/mL at 25°C(lit.)
MDL:	MFCD00013429
LogP:	3.30240

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Related Functional Groups

Sulfur Compounds

[72799-34-9]C11H12N2O2S
3-(2-Ethoxyphenyl)-2-Thioxoimidazolidin-4-One
[2039-96-5]C6H15NaO3SSi
3-(Trimethylsilyl)-1-propanesulfonic acid sodium salt
[832739-83-0]C13H12ClNO3S
3-[(4-Chlorophenyl)sulfonyl]-5-methoxyaniline
[862649-86-3]C12H8ClNO5S
3-[(4-Chlorophenyl)sulfonyl]-5-nitrophenol
[874-87-3]C8H9ClS
4-(Methylthio)benzyl chloride
[15863-41-9]C8H7NS2
4-(Methylthio)phenyl isothiocyanate

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GHS Hazard Statement:	H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
AU-2017346972-A1	Process for leaching metal sulfides with reagents having thiocarbonyl functional groups	20161019
CA-3032992-A1	Process for leaching metal sulfides with reagents having thiocarbonyl functional groups	20161019
CA-3052572-A1	Process for leaching metal sulfides with reagents having thiocarbonyl functional groups	20161019
CA-3052576-A1	Process for leaching metal sulfides with reagents having thiocarbonyl functional groups	20161019
EP-3529387-A1	Process for leaching metal sulfides with reagents having thiocarbonyl functional groups	20161019

Complexity:	119
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.9521202
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	187.9521202
Rotatable Bond Count:	2
Topological Polar Surface Area:	57.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.9