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Basic information
- CAS
7764-29-6- Standard SMILES
O=C1c2ccccc2C(=O)N1SN1C(=O)c2ccccc2C1=O- InChIKey
QYIWBOWEQBEAGP-UHFFFAOYSA-N- Molecular formula
- C16H8N2O4S
- Average molar mass
- 324.3 g/mol
- Monoisotopic mass
- 324.02047774
Overview
structure in first source
Names & identifiers
- Preferred name
- 2,2'-Thiobis(1H-isoindole-1,3(2H)-dione)
- IUPAC
- 2-(1,3-dioxoisoindol-2-yl)sulfanylisoindole-1,3-dione
- English name
- N,N'-Thio-bis(phthalimide)
- Molecular formula
- C16H8N2O4S
- Molecular weight
- 324.31
Names & synonyms
7764-29-6N,N'-Thiobisphthalimide2,2'-Thiobis[1H-isoindole-1,3(2H)-dione]DTXSID502282922,2'-Thiobis(1H-isoindole-1,3(2H)-dione)RefChem:821988DTXCID70150783231-856-52,2'-thiobis(isoindoline-1,3-dione)N,N'-Thiodiphthalimiden,n'-thio-bis(phthalimide)N,N-Thiobisphthalimide
Show more names
NSC 75099N,NÕ-ThiobisphthalimideN,N'-Thiodiphthalimide (>N,N'-Thiodiphthalimide (>90%)N N'-THIOBISPHTHALIMIDE 98+%2,2'-thiodiisoindoline-1,3-dione
2-(1,3-dioxoisoindol-2-yl)sulfanylisoindole-1,3-dioneMFCD000145811H-Isoindole-1,3(2H)-dione, 2,2'-thiobis-N,N'-Thiodiphthalimide (>90%)NSC-750992-[(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)sulfanyl]-2,3-dihydro-1H-isoindole-1,3-dioneC16H8N2O4S2,2'-thiobis(isoindoline-1,3-dione); N,N'-thiodi Phthalimide; 2,2'-Thiobis[1H-isoindole-1,3(2H)-dione]; N,N'-Thiobisphthalimide
Database identifiers
- CAS
7764-29-6- PubChem CID
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 495
Physicochemical properties
- Melting point
- 214 · 214-218 °C(lit.)
- Boiling point
- 553 · 553.0±33.0 °C(Predicted)
- Density
- 1.68 · 1.68±0.1 g/cm3(Predicted)
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- Chloroform (Slightly)
- form
- Solid
- pka
- -2.81 · -2.81±0.20(Predicted)
- color
- Off-White to Pale Yellow
- Stability
- Hygroscopic
- InChIKey
- QYIWBOWEQBEAGP-UHFFFAOYSA-N
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H317
- Precautionary statements
- 280 · P280
- WGK Germany
- 3 · 3
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H317
- Precautionary statements
- P280
Chemistry & industry
Applications
UsesN,N''-Thiodiphthalimide has been used in the design, synthesis and biological evaluation of novel podophyllotoxin derivatives bearing 4β-disulfide/trisulfide bond as cytotoxic agents.
Suppliers25 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
苏州驰瑞智合生物科技有限公司0512-13626191578 13626191578 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Aladdin Scientific[email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
湖北魏氏化学试剂股份有限公司13125137732 18686406941 · [email protected]
湖北创联康成药物化学有限公司027-65388397 18164111589 · [email protected]
Related reactions
37 records
Compound notes
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