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1,3-Dioxolane-4-methanol, 2-ethenyl-, trans-

HCID 85273
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
16081-27-9
Standard SMILES
C=C[C@@H]1OC[C@@H](CO)O1
InChIKey
JMAUXGPDSZGZAJ-PHDIDXHHSA-N
Molecular formula
C6H10O3
Average molar mass
130.14 g/mol
Monoisotopic mass
130.06299418

Names & identifiers

Preferred name
1,3-Dioxolane-4-methanol, 2-ethenyl-, trans-
IUPAC
[(2R,4R)-2-ethenyl-1,3-dioxolan-4-yl]methanol
English name
trans-2-vinyl-1,3-dioxolane-4-methanol
Molecular formula
C6H10O3
Molecular weight
130.14

Names & synonyms

trans-2-Vinyl-1,3-dioxolane-4-methanolEINECS 240-232-11,3-Dioxolane-4-methanol, 2-ethenyl-, trans-RefChem:218993240-232-116081-27-9[(2r,4r)-2-ethenyl-1,3-dioxolan-4-yl]methanolSCHEMBL9454896DTXSID3012591441,3-Dioxolane-4-methanol, 2-ethenyl-, trans- (9CI)

Database identifiers

CAS
16081-27-9
PubChem CID
85273
DTXSID
DTXSID301259144
EC Number
240-232-1
Nikkaji
J281.602D

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
38.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
9
Formal charge
0
Complexity
102

Physicochemical properties

Boiling point
102 · 102-103 °C(Press: 12 Torr)
Density
1.13 g/cm3 · 1.130 g/cm3(Temp: 23 °C)
pka
14.2 · 14.20±0.10(Predicted)
EPA Substance Registry System
1 · 1,3-Dioxolane-4-methanol, 2-ethenyl-, trans- (16081-27-9)

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

Regulatory InformationChemical: 1,3-Dioxolane-4-methanol, 2-ethenyl-, trans-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Chemistry & industry

Suppliers1 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

Related reactions

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Compound notes

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