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2-Vinyl-1,3-dioxane

HCID 80043
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5935-25-1
Standard SMILES
C=CC1OCCCO1
InChIKey
MBUIVAAHRBEDCW-UHFFFAOYSA-N
Molecular formula
C6H10O2
Average molar mass
114.14 g/mol
Monoisotopic mass
114.06807956

Names & identifiers

Preferred name
2-Vinyl-1,3-dioxane
IUPAC
2-ethenyl-1,3-dioxane
English name
2-vinyl-1,3-dioxane
Molecular formula
C6H10O2
Molecular weight
114.1424

Names & synonyms

2-Vinyl-1,3-dioxane2-ethenyl-1,3-dioxane5935-25-11,3-Dioxane, 2-ethenyl-C2NR6F929XEINECS 227-689-2NSC-378227DTXSID90208098NSC 378227RefChem:89522DTXCID10130589227-689-2
Show more names
Propenal trimethylene acetal1,3-Dioxane,2-ethenyl,EINECS 227-689-2,2-ethylene-1,3-dioxane cyclic acetal
NSC378227UNII-C2NR6F929XSCHEMBL5691727DB-314388NS00034140EN300-7591838

Database identifiers

CAS
5935-25-1
PubChem CID
80043
DTXSID
DTXSID90208098
UNII
C2NR6F929X
EC Number
227-689-2
Nikkaji
J223.899C

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
8
Formal charge
0
Complexity
74.6

Physicochemical properties

FDA UNII
2 NR6F929X · C2NR6F929X
Symbol(GHS)
2 · GHS02,GHS06
Signal word
Danger
Hazard statements
226 · H226-H301
Precautionary statements
264 · P264-P270-P301+P310-P321-P330-P405-P501

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P316, P303+P361+P353, P321, P330, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS02,GHS06
Hazard statements
H226-H301
Precautionary statements
P264-P270-P301+P310-P321-P330-P405-P501

Chemistry & industry

Upstream & downstream products

Upstream raw materials

1,1,3-TriethoxypropaneEthanol1,3-PropanediolAcrolein

Related reactions

1 records
New reaction record
HRID 2398090 reaction equation
HRID 2398090As reactantuspto-grants-1977_05

Compound notes

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