(R)-3-Hydroxybutanoic acid structure
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Common Name | (R)-3-Hydroxybutanoic acid | ||
|---|---|---|---|---|
| CAS Number | 625-72-9 | Molecular Weight | 104.10500 | |
| Density | 1.195 g/cm3 | Boiling Point | 269.2ºC at 760 mmHg | |
| Molecular Formula | C4H8O3 | Melting Point | 49-50ºC(lit.) | |
| MSDS | USA | Flash Point | 112ºC | |
Use of (R)-3-Hydroxybutanoic acid(R)-3-Hydroxybutanoic acid is a metabolite, and converted from acetoacetic acid catalyzed by 3-hydroxybutyrate dehydrogenase. |
Summary: (R)-3-hydroxybutyric acid, also known as (R)-3-Hydroxybutanoic acid, with CAS number 625-72-9, has a molecular formula of C4H8O3 and a molecular weight of 104.10500. It appears as a white crystal, with a melting point of 49-50°C and a boiling point of 269.2°C. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (R)-3-hydroxybutyric acid |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | (R)-3-Hydroxybutanoic acid is a metabolite, and converted from acetoacetic acid catalyzed by 3-hydroxybutyrate dehydrogenase. |
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| Related Catalog | |
| Target |
Human Endogenous Metabolite |
| In Vitro | (R)-3-Hydroxybutanoic acid (D-3-Hydroxybutyric acid) is a metabolite, and converted from acetoacetic acid. Enhanced hepatic fatty acid oxidation results in the increased production of acetoacetic acid which is in turn converted to (R)-3-Hydroxybutanoic acid by a reaction catalyzed by 3-hydroxybutyrate dehydrogenase[1]. |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.195 g/cm3 |
|---|---|
| Boiling Point | 269.2ºC at 760 mmHg |
| Melting Point | 49-50ºC(lit.) |
| Molecular Formula | C4H8O3 |
| Molecular Weight | 104.10500 |
| Flash Point | 112ºC |
| Exact Mass | 104.04700 |
| PSA | 57.53000 |
| Index of Refraction | 1.455 |
| InChIKey | WHBMMWSBFZVSSR-GSVOUGTGSA-N |
| SMILES | CC(O)CC(=O)O |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
|---|---|
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | 26-36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2918199090 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
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| DownStream 10 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2918199090 |
|---|---|
| Summary | 2918199090 other carboxylic acids with alcohol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Use of high-resolution proton nuclear magnetic resonance spectroscopy for rapid multi-component analysis of urine.
Clin. Chem. 30(3) , 426-32, (1984) Numerous low-Mr metabolites--including creatinine, citrate, hippurate, glucose, ketone bodies, and various amino acids--have been identified in 400- and 500-MHz proton nuclear magnetic resonance (1H N... |
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1,5-anhydroglucitol and postprandial hyperglycemia as measured by continuous glucose monitoring system in moderately controlled patients with diabetes.
Diabetes Care 29(6) , 1214-9, (2006) Postprandial hyperglycemia is often inadequately assessed in diabetes management. Serum 1,5-anhydroglucitol (1,5-AG) drops as serum glucose rises above the renal threshold for glucose and has been pro... |
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Can serum beta-hydroxybutyrate be used to diagnose diabetic ketoacidosis?
Diabetes Care 31(4) , 643-7, (2008) Current criteria for the diagnosis of diabetic ketoacidosis (DKA) are limited by their nonspecificity (serum bicarbonate [HCO(3)] and pH) and qualitative nature (the presence of ketonemia/ketonuria). ... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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Name: Absorbance-based primary biochemical high throughput screening assay to identify acti...
Source: The Scripps Research Institute Molecular Screening Center
Target: caspase-3 preproprotein [Homo sapiens]
External Id: PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule modulators of NR3A
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1015-NR3A-Primary-Assay
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Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (R)-3-HYDROXYBUTYRIC ACID |
| MFCD00066257 |
| EINECS 210-909-6 |
| D-3-Hydroxybutyric acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the uses of (R)-3-hydroxybutyric acid? |
| A: Main uses of (R)-3-hydroxybutyric acid: (R)-3-Hydroxybutanoic acid is a metabolite, and converted from acetoacetic acid catalyzed by 3-hydroxybutyrate dehydrogenase. |
| Q: What is the molecular formula of (R)-3-hydroxybutyric acid? |
| A: Molecular formula of (R)-3-hydroxybutyric acid is C4H8O3. |
| Q: What English synonyms does (R)-3-hydroxybutyric acid have? |
| A: English synonyms of (R)-3-hydroxybutyric acid: (R)-3-HYDROXYBUTYRIC ACID, MFCD00066257, EINECS 210-909-6, D-3-Hydroxybutyric acid. |
| Q: What is the CAS number of (R)-3-hydroxybutyric acid? |
| A: CAS number of (R)-3-hydroxybutyric acid is 625-72-9. |
| Q: What is the InChIKey of (R)-3-hydroxybutyric acid? |
| A: InChIKey of (R)-3-hydroxybutyric acid is WHBMMWSBFZVSSR-GSVOUGTGSA-N. |
| Q: What is the polar surface area (PSA) of (R)-3-hydroxybutyric acid? |
| A: Polar surface area (PSA) of (R)-3-hydroxybutyric acid is 57.53000. |
| Q: What is the English name of (R)-3-hydroxybutyric acid? |
| A: The English name of (R)-3-hydroxybutyric acid is (R)-3-hydroxybutyric acid. |
| Q: What is the molecular weight of (R)-3-hydroxybutyric acid? |
| A: Molecular weight of (R)-3-hydroxybutyric acid is 104.10500. |
| Q: What is the melting point of (R)-3-hydroxybutyric acid? |
| A: Melting point of (R)-3-hydroxybutyric acid is 49-50ºC(lit.). |
| Q: What are the downstream products of (R)-3-hydroxybutyric acid? |
| A: Related downstream products(CAS) of (R)-3-hydroxybutyric acid: 3976-69-0;17299-07-9;3724-65-0;7732-18-5;25139-77-9;2935-44-6;541-50-4;107-93-7;77383-04-1;85029-09-0. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |