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3-(4-Methoxyphenoxy)-1-propanesulfonyl chloride

3-(4-Methoxyphenoxy)-1-propanesulfonyl chloride - CAS 118943-25-2

Name: 3-(4-Methoxyphenoxy)-1-propanesulfonyl chloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB004350
Product Name:	3-(4-Methoxyphenoxy)-1-propanesulfonyl chloride
CAS:	118943-25-2
Synonyms:	3-(4-methoxyphenoxy)propane-1-sulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-(4-methoxyphenoxy)propane-1-sulfonyl chloride
Description:	3-(4-Methoxyphenoxy)-1-propanesulfonyl chloride (CAS# 118943-25-2) is a useful research chemical.
Molecular Weight:	264.73
Molecular Formula:	C10H13ClO4S
Canonical SMILES:	COC1=CC=C(C=C1)OCCCS(=O)(=O)Cl
InChI:	InChI=1S/C10H13ClO4S/c1-14-9-3-5-10(6-4-9)15-7-2-8-16(11,12)13/h3-6H,2,7-8H2,1H3
InChI Key:	UFZBQBXKJZWBBV-UHFFFAOYSA-N
Boiling Point:	389.4 °C at 760 mmHg
Melting Point:	45-46.7 °C (lit.)
Purity:	95 %
Density:	1.304 g/cm³
MDL:	MFCD04039947
LogP:	3.11350

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Related Functional Groups

Sulfur Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[2006276-82-8]C9H12ClNO4S2
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide
[72799-34-9]C11H12N2O2S
3-(2-Ethoxyphenyl)-2-Thioxoimidazolidin-4-One
[832739-83-0]C13H12ClNO3S
3-[(4-Chlorophenyl)sulfonyl]-5-methoxyaniline

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
AU-2011328904-A1	Agonists that enhance binding of integrin-expressing cells to integrin receptors	20101116
AU-2017201804-A1	Agonists that enhance binding of integrin-expressing cells to integrin receptors	20101116
AU-2017201804-B2	Agonists that enhance binding of integrin-expressing cells to integrin receptors	20101116
AU-2018236756-A1	Agonists that enhance binding of integrin-expressing cells to integrin receptors	20101116
AU-2018236756-B2	Agonists that enhance binding of integrin-expressing cells to integrin receptors	20101116

Complexity:	278
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	264.0223078
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	264.0223078
Rotatable Bond Count:	6
Topological Polar Surface Area:	61 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9