4,4'-Methylenebis(benzenesulfonyl chloride)
Product Information
Molecular Formula
C13H10Cl2O4S2
Molecular Weight
365.25
Description
4,4'-Methylenebis(benzenesulfonyl chloride) (CAS# 3119-64-0) is a useful research chemical.
Synonyms
4-[(4-chlorosulfonylphenyl)methyl]benzenesulfonyl chloride
IUPAC Name
4-[(4-chlorosulfonylphenyl)methyl]benzenesulfonyl chloride
SMILES
C1=CC(=CC=C1CC2=CC=C(C=C2)S(=O)(=O)Cl)S(=O)(=O)Cl
InChI
InChI=1S/C13H10Cl2O4S2/c14-20(16,17)12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)21(15,18)19/h1-8H,9H2
InChI Key
YKMMQCFZCFAHOU-UHFFFAOYSA-N
Boiling Point
483.9 °C at 760 mmHg
Melting Point
123-125 °C (lit.)
Purity
95 %
Density
1.508 g/cm3
Appearance
White to almost white powder to crystal
LogP
5.29400
Safety Information
Hazards
H290:
May be corrosive to metals.
H314:
Causes severe skin burns and eye damage.
May be corrosive to metals.
H314:
Causes severe skin burns and eye damage.
Precautionary Statement
P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501
Signal Word
Danger
Computed Properties
XLogP3
3.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
4
Exact Mass
363.9397565 g/mol
Monoisotopic Mass
363.9397565 g/mol
Topological Polar Surface Area
85Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
482
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2020218003-A1 | N,n'-diarylurea derivative and thermosensitive recording material using same | 2019-04-26 |
| JP-WO2020218003-A1 | N, N'-diarylurea derivative and heat-sensitive recording material using it | 2019-04-26 |
| JP-2020152667-A | N, N'-diarylurea derivative and its production method, and heat-sensitive recording material using it. | 2019-03-19 |
| JP-6968434-B2 | N, N'-diarylurea derivative and its production method, and heat-sensitive recording material using it. | 2019-03-19 |
| US-2018016445-A1 | Crosslinked phenolic compound, method of forming, and polymer composition containing the same | 2016-07-12 |
| US-10731040-B2 | Crosslinked phenolic compound, method of forming, and polymer composition containing the same | 2016-07-12 |
| EP-3330097-A1 | Lithographic printing original plate and plate making method | 2015-07-31 |
| EP-3330097-B1 | Lithographic printing original plate and plate making method | 2015-07-31 |
| CN-104678028-B | The pre-treatment of biological original amine neurotransmitters and detection method and detection kit | 2015-02-12 |
| CA-2801638-A1 | Polyamide thin film composite formed by interfacial polymerization | 2010-06-04 |
