Basic information
- CAS
16538-91-3- Standard SMILES
CC(=O)CCCCCCC(C)=O- InChIKey
YUMJAVUEKNJIQY-UHFFFAOYSA-N- Molecular formula
- C10H18O2
- Average molar mass
- 170.25 g/mol
- Monoisotopic mass
- 170.13067981
Names & identifiers
- Preferred name
- Decane-2,9-dione
- IUPAC
- decane-2,9-dione
- English name
- 2,9-Decanedione
- Molecular formula
- C10H18O2
- Molecular weight
- 170.25
Names & synonyms
decane-2,9-dione16538-91-3DTXSID20336939RefChem:585372DTXCID40288027800-053-72,9-DecanedioneMFCD03413036SCHEMBL3626142YUMJAVUEKNJIQY-UHFFFAOYSA-NRAA53891AKOS006276400
Show more names
2,9-Decadione
EBC-618250SB34127AS-56609SY274961DB-342553CS-0155059C73196EN300-6504992
Database identifiers
- CAS
16538-91-3- PubChem CID
- 537414
- DTXSID
DTXSID20336939- EC Number
- 800-053-7
- Nikkaji
- J403.385J
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Melting point
- 64 °C · 64 °C
- Boiling point
- 137 °C · 137 °C(Press: 12 Torr)
- Density
- 0.906 · 0.906±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- color
- Off-White to Pale Beige
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers18 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
成都麦卡希化工有限公司028-85632863 18108198598 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海途志化工有限公司19542790274 · [email protected]
上海瀚思化工有限公司17717618050 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
上海智乾生物科技有限公司[email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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