Basic information
- CAS
3406-02-8- Standard SMILES
O=S(=O)(CS(=O)(=O)c1ccccc1)c1ccccc1- InChIKey
QCHNSJNRFSOCLJ-UHFFFAOYSA-N- Molecular formula
- C13H12O4S2
- Average molar mass
- 296.4 g/mol
- Monoisotopic mass
- 296.01770121
Overview
structure in first source
Names & identifiers
- Preferred name
- Bis(phenylsulfonyl)methane
- IUPAC
- benzenesulfonylmethylsulfonylbenzene
- English name
- Bis(phenylsulfonyl)methane
- Molecular formula
- C13H12O4S2
- Molecular weight
- 296.36
Names & synonyms
Bis(phenylsulfonyl)methane3406-02-8(Methylenebis(sulphonyl))bisbenzeneX638VBN9T9NSC-47076DTXSID10187659[methylenebis(sulphonyl)]bisbenzeneRefChem:70151DTXCID20110150222-291-5bis(benzenesulfonyl)methaneBenzene, 1,1'-[methylenebis(sulfonyl)]bis-
Show more names
NSC 47076AKOS 90237Di(phenylsulfonyl)methaneBIS(PHENYLSULPHONYL)METHANEBis-(phenylsulfonyl)-methan(Methylenedisulfonyl)dibenzeneBis(phenylsulfonyl)methane,96%
benzenesulfonylmethylsulfonylbenzeneMethylenebis(phenyl sulfone)MFCD00007553MLS002608794[Methylenebis(sulfonyl)]bisbenzene{[(phenylsulfonyl)methyl]sulfonyl}benzene([(Phenylsulfonyl)methyl]sulfonyl)benzene(benzenesulfonyl)methanesulfonylbenzene
Database identifiers
- CAS
3406-02-8- PubChem CID
- 76948
- DTXSID
DTXSID10187659
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 424
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 119 · 119-121 °C(lit.)
- Boiling point
- 407.96 °C · 407.96°C (rough estimate)
- Density
- 1.363 · 1.363
- refractive index
- 1.436 · 1.4360 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- soluble in Methanol
- form
- Powder
- color
- White
- BRN
- 2057401 · 2057401
- InChIKey
- QCHNSJNRFSOCLJ-UHFFFAOYSA-N
- CAS DataBase Reference
- 3406 · 3406-02-8(CAS DataBase Reference)
- FDA UNII
- 638 VBN9T9 · X638VBN9T9
- Symbol(GHS)
- 7 · GHS07
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 29049090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers74 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海硅兰医药科技有限公司17301772648; 17301772648 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司
Related reactions
2 records
Compound notes
Loading…