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Vinyl isobutyrate

HCID 75503
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2424-98-8
Standard SMILES
C=COC(=O)C(C)C
InChIKey
WNMORWGTPVWAIB-UHFFFAOYSA-N
Molecular formula
C6H10O2
Average molar mass
114.14 g/mol
Monoisotopic mass
114.06807956

Names & identifiers

Preferred name
Vinyl isobutyrate
IUPAC
ethenyl 2-methylpropanoate
English name
vinyl isobutyrate
Molecular formula
C6H10O2
Molecular weight
114.14

Names & synonyms

Vinyl isobutyrateEthenyl 2-methylpropanoate2424-98-8EINECS 219-362-8Propanoic acid, 2-methyl-, ethenyl esterDTXSID40178934RefChem:194321DTXCID00101425219-362-8vinyl isobutanoate6U2ADY47FDIsobutyric acid, vinyl ester
Show more names
2-Methylpropanoic acid ethenyl ester
SCHEMBL93534SCHEMBL4201386WNMORWGTPVWAIB-UHFFFAOYSA-NISOBUTYRIC ACID VINYL ESTERAKOS006274673NS00027599

Database identifiers

CAS
2424-98-8
PubChem CID
75503
DTXSID
DTXSID40178934
UNII
6U2ADY47FD
EC Number
219-362-8
Nikkaji
J216.069B

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
94.7

Experimental & physicochemical properties

SpringerMaterials PropertiesDensity

Physicochemical properties

Melting point
37.22 °C · 37.22°C (estimate)
Boiling point
123.66 °C · 123.66°C (estimate)
Density
0.8932 · 0.8932
refractive index
1.4061 · 1.4061
FDA UNII
6 U2ADY47FD · 6U2ADY47FD
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

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

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers3 total

BOC Sciences16314854226; +8616314854226 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [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