Completing data — refresh the page later to see the latest
Basic information
- CAS
6337-34-4- Standard SMILES
CC1(C)OC(=O)C(c2ccccc2)O1- InChIKey
JKKLKPFEVGIRGI-UHFFFAOYSA-N- Molecular formula
- C11H12O3
- Average molar mass
- 192.21 g/mol
- Monoisotopic mass
- 192.07864424
Names & identifiers
- Preferred name
- 2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one
- IUPAC
- 2,2-dimethyl-5-phenyl-1,3-dioxolan-4-one
- English name
- 2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one
- Molecular formula
- C11H12O3
- Molecular weight
- 192.21
Names & synonyms
2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one6337-34-42,2-dimethyl-5-phenyl-[1,3]dioxolan-4-oneMFCD0132762071851-12-21,3-Dioxolan-4-one, 2,2-dimethyl-5-phenyl-NSC38017SCHEMBL8592625SCHEMBL11897875JKKLKPFEVGIRGI-UHFFFAOYSA-DTXSID10992568JKKLKPFEVGIRGI-UHFFFAOYSA-N
Show more names
NSC-38017AKOS003851283AS-5902CS-03267672,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one #F317275InChI=1/C11H12O3/c1-11(2)13-9(10(12)14-11)8-6-4-3-5-7-8/h3-7,9H,1-2H3
Database identifiers
- CAS
6337-34-4、71851-12-2- PubChem CID
- 236010
- DTXSID
DTXSID10992568- Nikkaji
- J258.629K
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Melting point
- 45 °C · 45 °C
- Boiling point
- 302.9 · 302.9±30.0 °C(Predicted)
- Density
- 1.131 · 1.131±0.06 g/cm3(Predicted)
- HS Code
- 2914120000 · 2914120000
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
- hs_code
- 2914120000
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
Advanced Chemical Intermediates Ltd.[email protected]
常州科化生物科技有限公司[email protected]
SYNQUEST[email protected]
MATRIX[email protected]
APOLLO-NMR[email protected]
高级化学中间体有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…