Basic information
- CAS
4580-40-9- Standard SMILES
C#CCOC(=O)CCC(=O)OCC#C- InChIKey
MNANQFINLWEMEJ-UHFFFAOYSA-N- Molecular formula
- C10H10O4
- Average molar mass
- 194.18 g/mol
- Monoisotopic mass
- 194.0579088
Names & identifiers
- Preferred name
- Diprop-2-ynyl butanedioate
- IUPAC
- bis(prop-2-ynyl) butanedioate
- English name
- diprop-2-ynyl butanedioate
- Molecular formula
- C10H10O4
- Molecular weight
- 194.18
Names & synonyms
DIPROP-2-YNYL BUTANEDIOATE4580-40-9di(prop-2-yn-1-yl) succinatebis(prop-2-ynyl) butanedioate1,4-BIS(PROP-2-YN-1-YL) BUTANEDIOATEBis-propargyl-succinateNSC525130SCHEMBL4446043DTXSID20326178Di(prop-2-yn-1-yl) butanedioateMFCD00996347AKOS024257270
Show more names
dipropyn-2-yl succinatediprop-2-yn-1-yl butanedioatedipropyl-2-yneylbutanediacidesterButanedioic acid, 1,4-di-2-propyn-1-yl ester
NSC-525130AS-58675A11136F813194
Database identifiers
- CAS
4580-40-9- PubChem CID
- 352128
- DTXSID
DTXSID20326178- Nikkaji
- J1.952.788C
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Melting point
- 39 · 39-40 °C
- Boiling point
- 273.1 · 273.1±20.0 °C(Predicted)
- Density
- 1.155 · 1.155±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers10 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
贵州易妥化学科技有限公司18628235590 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海纳孚生物科技有限公司021-58952328 13125124762 · [email protected]
上海琼燕医药科技有限公司086-021-15821262312 15821262312 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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