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Basic information
- CAS
2916-31-6- Standard SMILES
CC1(C)OCCO1- InChIKey
SIJBDWPVNAYVGY-UHFFFAOYSA-N- Molecular formula
- C5H10O2
- Average molar mass
- 102.13 g/mol
- Monoisotopic mass
- 102.06807956
Names & identifiers
- Preferred name
- 2,2-Dimethyl-1,3-dioxolane
- IUPAC
- 2,2-dimethyl-1,3-dioxolane
- English name
- 2,2-Dimethyl-1,3-dioxolane
- Molecular formula
- C5H10O2
- Molecular weight
- 102.13
Names & synonyms
2,2-Dimethyl-1,3-dioxolane2916-31-61,3-Dioxolane, 2,2-dimethyl-EINECS 220-842-4Acetone, cyclic ethylene acetalSIJBDWPVNAYVGY-UHFFFAOYSA-DTXSID10183419NSC 86111RefChem:81035DTXCID70105910220-842-4InChI=1/C5H10O2/c1-5(2)6-3-4-7-5/h3-4H2,1-2H3
Show more names
ACETONE ETHYLENE CETALAcetone ethylene ketal2,2-DIMETHYL-1,3-DIOXOLAN2,2-Dimethyl-1,3-dioxolane>2,2-Dimethyl-1,3-dioxalane-98%2,2-DIMETHYL-1,3-DIOXOLANE, 98+%
SIJBDWPVNAYVGY-UHFFFAOYSA-NAcetone ethylene acetalMFCD000141062.2-dimethyl-1.3-dioxolane1,3-Dioxolane, dimethyl-NSC86111SCHEMBL85991SCHEMBL332117
Database identifiers
- CAS
2916-31-6- PubChem CID
- 76209
- DTXSID
DTXSID10183419- ChEMBL
CHEMBL5285009- EC Number
- 220-842-4
- Nikkaji
- J121.008D
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 60
Physicochemical properties
- Boiling point
- 92 · 92-93 °C(lit.)
- Density
- 0.926 g/mL · 0.926 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.398(lit.)
- Flash point
- 35 °F · 35 °F
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- 300 g/l · 300g/l
- form
- clear liquid
- color
- Colorless to Almost colorless
- Water Solubility
- Insoluble in water.
- BRN
- 102775 · 102775
- Henry's Law Constant
- 4.8 · 4.8×10-1 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- InChI
- 1S/C5H10O2/c1-5(2)6-3-4-7-5/h3-4H2,1-2H3
- InChIKey
- SIJBDWPVNAYVGY-UHFFFAOYSA-N
- SMILES
- CC1(C)OCCO1
- CAS DataBase Reference
- 2916 · 2916-31-6(CAS DataBase Reference)
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
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 1993 3/PG 2
- hs_code
- 2932.99.9090
- risk_code
- 11
- Signal word
- Danger
- Symbol(GHS)
- GHS02
- hazard_code
- F
- safety_code
- 16
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H225
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Flam. Liq. 2
- Precautionary statements
- P210
Chemistry & industry
Applications
Uses2,2-Dimethyl-1,3-dioxolane is used as organic intermediates, fine chemicals, pharmaceutical research and development.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers64 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海颖心实验室设备有限公司021-59178156 17002132182 · [email protected]
Related reactions
3 records
Compound notes
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