2-Hydroxy-1-methylethyl acrylate
Basic information
- CAS
2918-23-2- Standard SMILES
C=CC(=O)OC(C)CO- InChIKey
UXYMHGCNVRUGNO-UHFFFAOYSA-N- Molecular formula
- C6H10O3
- Average molar mass
- 130.14 g/mol
- Monoisotopic mass
- 130.06299418
Overview
See also: 2-Hydroxy-1-methylethylacrylate (annotation moved to).
Names & identifiers
- Preferred name
- 2-Hydroxy-1-methylethyl acrylate
- IUPAC
- 1-hydroxypropan-2-yl prop-2-enoate
- English name
- 2-hydroxy-1-methylethyl acrylate
- Molecular formula
- C6H10O3
- Molecular weight
- 130.14
Names & synonyms
2-Propenoic acid, 2-hydroxy-1-methylethyl ester2-Hydroxy-1-methylethyl acrylateRefChem:4730212918-23-21-hydroxypropan-2-yl prop-2-enoate2-HYDROXYISOPROPYL ACRYLATE8I7F32PB8PUNII-8I7F32PB8PEINECS 220-852-9SCHEMBL3775821-hydroxypropan-2-yl acrylateSCHEMBL2011391
Show more names
α-Methylolethyl Acrylate1,2-Propanediol 2-acrylate*Ethyl Acetate Impurity 254ACRYLICACID,2-HYDROXYISOPROPYLESTER2-hydroxy-1-methylethyl acrylate(HPA)Acrylic acid 2-hydroxy-1-methylethyl ester
SCHEMBL28028094DTXSID90951774UXYMHGCNVRUGNO-UHFFFAOYSA-N1-Hydroxypropan-2-yl prop-2-enoatatoNS00049002Q27270568
Database identifiers
- CAS
2918-23-2- PubChem CID
- 94246
- DTXSID
DTXSID90951774- UNII
- 8I7F32PB8P
- EC Number
- 220-852-9
- Nikkaji
- J175.472F
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 109
Physicochemical properties
- Boiling point
- 200.2 · 200.2±23.0 °C(Predicted)
- Density
- 1.049 · 1.049±0.06 g/cm3(Predicted)
- pka
- 14.05 · 14.05±0.10(Predicted)
- InChI
- InChI=1S/C6H10O3/c1-3-6(8)9-5(2)4-7/h3,5,7H,1,4H2,2H3
- InChIKey
- UXYMHGCNVRUGNO-UHFFFAOYSA-N
- SMILES
- C(OC(C)CO)(=O)C=C
- FDA UNII
- 8 I7F32PB8P · 8I7F32PB8P
- EPA Substance Registry System
- 2 · 2-Propenoic acid, 2-hydroxy-1-methylethyl ester (2918-23-2)
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H314-H317-H331
- Precautionary statements
- 264 · P264-P270-P280-P260-P261-P272-P271-P301+P310-P330-P302+P352-P312-P361+P364-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P305+P351+P338-P333+P313-P362+P364-P311-P405-P403+P233-P501
- RIDADR
- 2922 · 2922
- HazardClass
- 8 · 8
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P262, P264, P270, P271, P272, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P361+P364, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 121 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 CategoriesAcute Tox. 3 (100%)
Safety data
- ridadr
- 2922
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- hazard_class
- 8
- packing_group
- II
- Hazard statements
- H301-H311-H314-H317-H331
- Precautionary statements
- P264-P270-P280-P260-P261-P272-P271-P301+P310-P330-P302+P352-P312-P361+P364-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P305+P351+P338-P333+P313-P362+P364-P311-P405-P403+P233-P501
Chemistry & industry
Applications
Usesα-Methylolethyl Acrylate is an acrylic ester which are monomers used in polymer formulations because of highly reactive α,β-unsaturated carboxyl structure.
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Compound notes
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