(+)-Isobutyl D-lactate
(+)-Isobutyl D-lactate structure
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Common Name | (+)-Isobutyl D-lactate | ||
|---|---|---|---|---|
| CAS Number | 61597-96-4 | Molecular Weight | 146.18400 | |
| Density | 0.971 | Boiling Point | 73ºC (13 mmHg) | |
| Molecular Formula | C7H14O3 | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 152.6 °F | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: (R)-(+)-Isobutyl D-lactate, Chinese name (R)-乳酸异丁酯, CAS number 61597-96-4, molecular formula C7H14O3, molecular weight 146.18400. The compound is a colorless liquid with a boiling point of 73ºC (13 mmHg) and a density of 0.971. 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 | (+)-Isobutyl D-lactate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.971 |
|---|---|
| Boiling Point | 73ºC (13 mmHg) |
| Molecular Formula | C7H14O3 |
| Molecular Weight | 146.18400 |
| Exact Mass | 146.09400 |
| PSA | 46.53000 |
| LogP | 0.56640 |
| Index of Refraction | 1.419 |
| InChIKey | WBPAQKQBUKYCJS-ZCFIWIBFSA-N |
| SMILES | CC(C)COC(=O)C(C)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.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H319 |
| Precautionary Statements | P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36 |
| Safety Phrases | S26 |
| RIDADR | NA 1993 / PGIII |
| WGK Germany | 3 |
| HS Code | 2918110000 |
| Flash Point(F) | 152.6 °F |
| Flash Point(C) | 67 °C |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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(+)-Isobutyl D-... CAS#:61597-96-4 |
| Literature: Journal of the Chemical Society, , p. 1935 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 1 | |
|---|---|
| DownStream 8 | |
CAS#:4254-14-2
CAS#:188594-10-7
CAS#:103-50-4
CAS#:121408-94-4
CAS#:10326-41-7![Pyrrolidine, 1-[(2R)-2-hydroxy-1-oxopropyl]- (9CI) structure](https://image.chemsrc.com/caspic/370/151670-13-2.png)
CAS#:151670-13-2
CAS#:84681-87-8
CAS#:62108-67-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2918110000 |
|---|---|
| Summary | 2918110000. lactic acid, its salts and esters. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). 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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Direct separation of alpha-hydroxycarboxylic acid ester enantiomers by gas chromatography with optically active copper(II) complexes.
J. Chromatogr. A. 202(2) , 305-8, (1980)
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Safety assessment of lactate esters.
Regul Toxicol Pharmacol 27(2) , 88-97, (1998) Lactate esters have an oral LD50 greater than 2000 mg/kg and the inhalation LC50 is generally above 5000 mg/m3 and they may be potential eye and skin irritants, but not skin sensitizers. No evidence o... |
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[Repellent effect of Mannich bases, derivatives of lactic acid esters].
Med. Parazitol. (Mosk.) (1) , 44-8, (1987)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD00012307 |
| EINECS 407-770-0 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of (+)-Isobutyl D-lactate? |
| A: The English name of (+)-Isobutyl D-lactate is (+)-Isobutyl D-lactate. |
| Q: What is the InChIKey of (+)-Isobutyl D-lactate? |
| A: InChIKey of (+)-Isobutyl D-lactate is WBPAQKQBUKYCJS-ZCFIWIBFSA-N. |
| Q: What English synonyms does (+)-Isobutyl D-lactate have? |
| A: English synonyms of (+)-Isobutyl D-lactate: MFCD00012307, EINECS 407-770-0. |
| Q: What is the LogP of (+)-Isobutyl D-lactate? |
| A: LogP of (+)-Isobutyl D-lactate is 0.56640. |
| Q: What are the downstream products of (+)-Isobutyl D-lactate? |
| A: Related downstream products(CAS) of (+)-Isobutyl D-lactate: 4254-14-2;188594-10-7;103-50-4;121408-94-4;10326-41-7;151670-13-2;84681-87-8;62108-67-2. |
| Q: What is the polar surface area (PSA) of (+)-Isobutyl D-lactate? |
| A: Polar surface area (PSA) of (+)-Isobutyl D-lactate is 46.53000. |
| Q: What is the molecular weight of (+)-Isobutyl D-lactate? |
| A: Molecular weight of (+)-Isobutyl D-lactate is 146.18400. |
| Q: What is the molecular formula of (+)-Isobutyl D-lactate? |
| A: Molecular formula of (+)-Isobutyl D-lactate is C7H14O3. |
| Q: What is the boiling point of (+)-Isobutyl D-lactate? |
| A: Boiling point of (+)-Isobutyl D-lactate is 73ºC (13 mmHg). |
| Q: What is the SMILES notation of (+)-Isobutyl D-lactate? |
| A: SMILES notation of (+)-Isobutyl D-lactate is CC(C)COC(=O)C(C)O. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |