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4-Phenyl-1,3-dioxolane

HCID 70634
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1075-20-3
Standard SMILES
c1ccc(C2COCO2)cc1
InChIKey
OVKDCYKVNYLEHK-UHFFFAOYSA-N
Molecular formula
C9H10O2
Average molar mass
150.17 g/mol
Monoisotopic mass
150.06807956

Names & identifiers

Preferred name
4-Phenyl-1,3-dioxolane
IUPAC
4-phenyl-1,3-dioxolane
English name
4-phenyl-1,3-dioxolane
Molecular formula
C9H10O2
Molecular weight
150.17

Names & synonyms

4-Phenyl-1,3-dioxolane1075-20-31,3-Dioxolane, 4-phenyl-AI3-24753EINECS 214-051-3DTXSID008625241,3Dioxolane, 4phenylRefChem:100338DTXCID40811273214-051-3SCHEMBL528466SCHEMBL1866124
Show more names
SCHEMBL1936932SCHEMBL6924123SCHEMBL9096273OVKDCYKVNYLEHK-UHFFFAOYSA-NDB-263245NS00041963

Database identifiers

CAS
1075-20-3
PubChem CID
70634
DTXSID
DTXSID00862524
EC Number
214-051-3
Nikkaji
J25.453C

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
119

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Ethers, Other

Physicochemical properties

Boiling point
100 · 100-101 °C(Press: 12 Torr)
Density
1.1334 g/cm3 · 1.1334 g/cm3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Hazards SummarySee 1,3-Dioxolane.

Chemistry & industry

Suppliers2 total

CHEMSTEP[email protected]
CHEMICAL LAND21[email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes