(S)-2-Hydroxybutyric acid
Grundinformationen
- CAS
3347-90-8- Standard-SMILES
CC[C@H](O)C(=O)O- InChIKey
AFENDNXGAFYKQO-VKHMYHEASA-N- Summenformel
- C4H8O3
- Durchschnittliche Molmasse
- 104,1 g/mol
- Monoisotopische Masse
- 104,04734412
Überblick
(S)-2-hydroxybutyric acid is an optically active form of 2-hydroxybutyric acid having (S)-configuration. It is a 2-hydroxybutyric acid and a (2S)-2-hydroxy monocarboxylic acid. It is a conjugate acid of a (S)-2-hydroxybutyrate. It is an enantiomer of a (R)-2-hydroxybutyric acid.
Namen und Bezeichner
- Bevorzugter Name
- (S)-2-Hydroxybutyric acid
- IUPAC
- (2S)-2-hydroxybutanoic acid
- Englischer Name
- (S)-2-HYDROXYBUTYRIC ACID
- Summenformel
- C4H8O3
- Molmasse
- 104.1
Namen und Synonyme
(S)-2-Hydroxybutyric acid(S)-2-hydroxybutanoic acid(2S)-2-hydroxybutanoic acidL-2-hydroxybutanoic acidL-alpha-hydroxybutyric acidL-alpha-hydroxybutanoic acidCHEBI:50613DTXSID001312294RefChem:407941DTXCID001742093628-477-63347-90-8
Weitere Namen anzeigen
(S)-2-HYDROXYBUTYRIC(S)-2-HydroxybutyratePemafibrate Impurity 4Lactic acid impurity 72(2S)-2-Hydroxybutyric acid(S)-2-hydroxybutanoatic acid
2-HydroxybutyrateL-2-hydroxybutyric acidButanoic acid, 2-hydroxy-, (2S)-MFCD013185682-Hydroxybutyric acid, (+)-(S)-(+)-2-Hydroxybutanoic acid2S-Hydroxybutanoic acidS-2-hydroxybutyric acid
Datenbank-Bezeichner
- CAS
3347-90-8- PubChem CID
- 440864
- DTXSID
DTXSID001312294- ChEBI
CHEBI:50613- UNII
- 8X9IM06H49
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,1
- Polarare Oberfläche (TPSA)
- 57,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 69,3
Experimentelle und physikochemische Eigenschaften
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Hydroxy fatty acids [FA0105]
SpringerMaterials PropertiesDielectric constant
Melting Point44.2 °C
Physical DescriptionSolid
Collision Cross Section117.2 Ų [M-H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Physikochemische Eigenschaften
- Schmelzpunkt
- 50 · 50-54 °C
- Siedepunkt
- 238 ℃ · 238℃
- Dichte
- 1.195 · 1.195
- Flammpunkt
- 112 ℃ · 112℃
- storage temp.
- 2 · 2-8°C
- pka
- 3.83 · 3.83±0.10(Predicted)
- Aggregatzustand
- solid
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- F
- 3-10
- wgk
- 2
- hs_code
- 2918199890
- risk_code
- 37/38-41
- hazard_code
- Xi
- safety_code
- 26-37/39
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Dam. 1Skin Irrit. 2STOT SE 3
Chemie und Industrie
Pharmakologische Informationen
Tissue LocationsPlacenta
Cellular LocationsCytoplasm
Metabolite PathwaysMalonic Aciduria
Anwendungen
Verwenden(S)-2-Hydroxybutanoic acid is used in method for preparing Cationic Electrodeposition coating compounds.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter100 Anbieter
陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
Shanghai Yingrui Biopharma Co.,Ltd21-33585366 · [email protected]
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