Methyl 2-(hydroxymethyl)prop-2-enoate
Grundinformationen
- CAS
15484-46-5- Standard-SMILES
C=C(CO)C(=O)OC- InChIKey
RFUCOAQWQVDBEU-UHFFFAOYSA-N- Summenformel
- C5H8O3
- Durchschnittliche Molmasse
- 116,11 g/mol
- Monoisotopische Masse
- 116,04734412
Namen und Bezeichner
- Bevorzugter Name
- Methyl 2-(hydroxymethyl)prop-2-enoate
- IUPAC
- methyl 2-(hydroxymethyl)prop-2-enoate
- Englischer Name
- Methyl 2-(hydroxymethyl)acrylate
- Summenformel
- C5H8O3
- Molmasse
- 116.12
Namen und Synonyme
Methyl 2-(hydroxymethyl)prop-2-enoateRefChem:813724604-981-1METHYL 2-(HYDROXYMETHYL)ACRYLATE15484-46-5MFCD12545894Methyl2-(Hydroxymethyl)AcrylateMethyl-2-(hydroxymethyl)-acrylateSCHEMBL36299methyl 2-hydroxymethylacrylateCHEMBL1256639methyl alpha-hydroxymethylacrylate
Weitere Namen anzeigen
Methyl 2-(hydroxymethyl)Methyl 2-(hydroxymethyl)-2-propenoate2-Hydroxymethyl-acrylic acid methyl ester2-Propenoic acid, 2-(hydroxyMethyl)-, Methyl esterMethyl 2-(hydroxymethyl)acrylate, stabilied with BHTMethyl 2-(hydroxymethyl)acrylate,97%(stabilized with MEHQ)Methyl-2-(Hydroxymethyl)Acrylate(Telbivudine Intermediate)Methyl 2-(hydroxyMethyl)acrylate, stabilized with 0.1 wt.% MEHQMethyl 2-(hydroxyMethyl)acrylate, 93%, stabilized with 0.1 wt.% MEHQ
DTXSID204733582-hydroxymethylacrylate methyl ester2-methylolacrylic acid methyl estermethyl alpha-(hydroxymethyl)acrylateAKOS007930334CS-W019505GS-3868DA-17478
Datenbank-Bezeichner
- CAS
15484-46-5- PubChem CID
- 11815329
- DTXSID
DTXSID20473358- ChEMBL
CHEMBL1256639- EC Number
- 604-981-1
- Nikkaji
- J910.588C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,2
- Polarare Oberfläche (TPSA)
- 46,5 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 106
Physikochemische Eigenschaften
- Siedepunkt
- 63 · 63-65 °C(Press: 2.3 Torr)
- Dichte
- 1.129 g/mL · 1.129 g/mL at 25 °C
- Brechungsindex
- 20 · n20/D1.456
- Flammpunkt
- 90 ℃ · 90℃
- storage temp.
- 2 · 2-8°C
- pka
- 13.66 · 13.66±0.10(Predicted)
- Aggregatzustand
- liquid
- InChI
- InChI=1S/C5H8O3/c1-4(3-6)5(7)8-2/h6H,1,3H2,2H3
- InChIKey
- RFUCOAQWQVDBEU-UHFFFAOYSA-N
- SMILES
- C(OC)(=O)C(CO)=C
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Sicherheitsdaten
- wgk
- 1
- ridadr
- NA 1993 / PGIII
- hs_code
- 2918199890
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Skin Sens. 1
Chemie und Industrie
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