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1,3-Dioxan-5-ol, 2-ethenyl-, cis-

HCID 85274
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
16081-28-0
Standard SMILES
C=CC1OCC(O)CO1
InChIKey
RCORSHSFJCXHTF-UHFFFAOYSA-N
Molecular formula
C6H10O3
Average molar mass
130.14 g/mol
Monoisotopic mass
130.06299418

Names & identifiers

Preferred name
1,3-Dioxan-5-ol, 2-ethenyl-, cis-
IUPAC
2-ethenyl-1,3-dioxan-5-ol
English name
trans-2-vinyl-1,3-dioxan-5-ol
Molecular formula
C6H10O3
Molecular weight
130.14

Names & synonyms

1,3-Dioxan-5-ol, 2-ethenyl-, cis-1,3-Dioxan-5-ol, 2-ethenyl-, trans-RefChem:4147262-ethenyl-1,3-dioxan-5-olcis-2-Vinyl-1,3-dioxan-5-ol16081-28-016081-29-1trans-2-Vinyl-1,3-dioxan-5-ol2-vinyl-1,3-dioxan-5-ol4722-58-1EINECS 240-234-2Glycerine acetal
Show more names
EINECS 240-233-7(2r,5r)-2-ethenyl-1,3-dioxan-5-olSCHEMBL862307SCHEMBL9454897SCHEMBL9519197NIOSH/JI3460000DTXSID00936416RCORSHSFJCXHTF-IZLXSQMJSA-N

Database identifiers

CAS
16081-28-0、16081-29-1
PubChem CID
85274
DTXSID
DTXSID00936416
EC Number
240-233-7、240-234-2
Nikkaji
J281.603B、J281.605I

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
38.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
94.5

Physicochemical properties

Boiling point
109 · 109-110 °C(Press: 12 Torr)
Density
1.142 g/cm³ · 1.142 g/cm³(Temp: 23 °C)
pka
13.563 · 13.563±0.40(predicted)
EPA Substance Registry System
1 · 1,3-Dioxan-5-ol, 2-ethenyl-, trans- (16081-29-1)

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 Information · 2 items

Chemical: 1,3-Dioxan-5-ol, 2-ethenyl-, cis-

Chemical: 1,3-Dioxan-5-ol, 2-ethenyl-, trans-

Other Safety Information · 2 items

Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Chemistry & industry

Suppliers2 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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