Basic information
- CAS
1522-89-0- Standard SMILES
Cc1ccc(S(=O)(=O)OCC(COS(=O)(=O)c2ccc(C)cc2)(COS(=O)(=O)c2ccc(C)cc2)COS(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
KBTUOVZRXXHLOB-UHFFFAOYSA-N- Molecular formula
- C33H36O12S4
- Average molar mass
- 752.9 g/mol
- Monoisotopic mass
- 752.10896059
Names & identifiers
- Preferred name
- [3-(4-Methylphenyl)sulfonyloxy-2,2-bis[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate
- IUPAC
- [3-(4-methylphenyl)sulfonyloxy-2,2-bis[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate
- English name
- 2,2-bis(tosyloxymethyl)propane-1,3-diyl bis(4-methylbenzenesulfonate)
- Molecular formula
- C33H36O12S4
- Molecular weight
- 752.89
Names & synonyms
1522-89-0[3-(4-methylphenyl)sulfonyloxy-2,2-bis[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate2,2-Bis((tosyloxy)methyl)propane-1,3-diyl bis(4-methylbenzenesulfonate)2,2-Bis(tosyloxymethyl)propane-1,3-diyl bis(4-methylbenzenesulfonate)pentaerythritol tetratosylateKBTUOVZRXXHLOB-UHFFFAOYSA-NNSC179394Pentaerythrit-tetratosylatSCHEMBL1742195DTXSID30306704AKOS024303987NSC 179394
Show more names
PENTAERYTHRITOL TETRAKIS(P-TOLUENESULFONATE)1,3-Propanediol, 2,2-bis[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, 1,3-bis(4-methylbenzenesulfonate)
NSC-179394Tetra-O-4-methylphenylsulfonylpentaerythritolmethanetetrayltetramethylene tetra-p-toluenesulfonate2,2-Bis((tosyloxy)methyl)propane-1,3-diylbis(4-methylbenzenesulfonate)2,2-Bis{[(4-methylbenzene-1-sulfonyl)oxy]methyl}propane-1,3-diyl bis(4-methylbenzene-1-sulfonate)3-{[(4-methylphenyl)sulfonyl]oxy}-2,2-bis({[(4-methylphenyl)sulfonyl]oxy}methyl)propyl 4-methylbenzenesulfonate
Database identifiers
- CAS
1522-89-0- PubChem CID
- 301538
- DTXSID
DTXSID30306704- Nikkaji
- J2.030.942C
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 207 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 16
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 1,230
Physicochemical properties
- Melting point
- 157 °C · 157 °C
- Boiling point
- 884.6 · 884.6±65.0 °C(Predicted)
- Density
- 1.378 · 1.378±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers14 total
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
北京亿思研科技开发中心010-56645598 13366904824 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
武汉肯达科讯科技有限公司18516102326 · [email protected]
安那莱（齐河）新材料科技有限公司18600642180（微信同） 13391601435 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
山东彬睿特新材料有限公司0533-2866658 15615638350 · [email protected]
Related reactions
3 records
Compound notes
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