(hydroxyimino)phenylacetonitrile
(hydroxyimino)phenylacetonitrile structure
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Common Name | (hydroxyimino)phenylacetonitrile | ||
|---|---|---|---|---|
| CAS Number | 825-52-5 | Molecular Weight | 146.14600 | |
| Density | 1.11g/cm3 | Boiling Point | 293.3ºC at 760 mmHg | |
| Molecular Formula | C8H6N2O | Melting Point | 128-130ºC(lit.) | |
| MSDS | USA | Flash Point | 131.2ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: (hydroxyimino)(phenyl)acetonitrile (CAS: 825-52-5, molecular formula: C8H6N2O, molecular weight: 146.14600), melting point 128-130°C, boiling point 293.3°C (760 mmHg), density 1.11g/cm3. 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 | (hydroxyimino)(phenyl)acetonitrile |
|---|---|
| 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 | 1.11g/cm3 |
|---|---|
| Boiling Point | 293.3ºC at 760 mmHg |
| Melting Point | 128-130ºC(lit.) |
| Molecular Formula | C8H6N2O |
| Molecular Weight | 146.14600 |
| Flash Point | 131.2ºC |
| Exact Mass | 146.04800 |
| PSA | 56.38000 |
| LogP | 1.38848 |
| Index of Refraction | 1.562 |
| InChIKey | MJCQFBKIFDVTTR-NTMALXAHSA-N |
| SMILES | N#CC(=NO)c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H312-H315-H319-H332-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xn: Harmful; |
| Risk Phrases | R20/21/22 |
| Safety Phrases | S22-S36/37 |
| RIDADR | NONH for all modes of transport |
| HS Code | 2926909090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 8 | |
CAS#:140-29-4
CAS#:110-46-3
CAS#:143-33-9
CAS#:698-16-8
CAS#:932-90-1
CAS#:13665-04-8
CAS#:544-16-1
CAS#:4589-97-3
CAS#:5728-14-3
CAS#:59577-32-1
CAS#:5398-63-0
CAS#:613-89-8
CAS#:17512-88-8
CAS#:16750-42-8
CAS#:10543-64-3
CAS#:5700-56-1This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none 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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E/Z oxime isomerism in PhC(NOH)CN.
Chemistry 19(13) , 4223-9, (2013) The reaction of nitric oxide with benzyl cyanide in the presence of potassium methoxide at low temperature gave the dipotassium salt of a bis-diazeniumdiolate 2 in excellent yield. Two new stereospeci... |
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Refinement of the crystal structure of 2-hydroxyimino-2-phenylacetonitrile, C8H6N2O, at 173 ?. Razzino P, et al.
Z. Kristallogr. - New Cryst. Struct. 216(1-4) , 583-84, (2001)
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A facile method for the preparation of oxime t-butyl carbonates for evaluation of the Beckman rearrangement. Mamaghani M and Samimi HA.
Orient. J. Chem. 24(3) , 837-41, (2008)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 212-546-9 |
| MFCD00035803 |
| 2-HYDROXYIMINO-2-PHENYLACETONITRILE |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of (hydroxyimino)(phenyl)acetonitrile? |
| A: Boiling point of (hydroxyimino)(phenyl)acetonitrile is 293.3ºC at 760 mmHg. |
| Q: What is the LogP of (hydroxyimino)(phenyl)acetonitrile? |
| A: LogP of (hydroxyimino)(phenyl)acetonitrile is 1.38848. |
| Q: What English synonyms does (hydroxyimino)(phenyl)acetonitrile have? |
| A: English synonyms of (hydroxyimino)(phenyl)acetonitrile: EINECS 212-546-9, MFCD00035803, 2-HYDROXYIMINO-2-PHENYLACETONITRILE. |
| Q: What is the melting point of (hydroxyimino)(phenyl)acetonitrile? |
| A: Melting point of (hydroxyimino)(phenyl)acetonitrile is 128-130ºC(lit.). |
| Q: What is the SMILES notation of (hydroxyimino)(phenyl)acetonitrile? |
| A: SMILES notation of (hydroxyimino)(phenyl)acetonitrile is N#CC(=NO)c1ccccc1. |
| Q: What is the InChIKey of (hydroxyimino)(phenyl)acetonitrile? |
| A: InChIKey of (hydroxyimino)(phenyl)acetonitrile is MJCQFBKIFDVTTR-NTMALXAHSA-N. |
| Q: What is the molecular weight of (hydroxyimino)(phenyl)acetonitrile? |
| A: Molecular weight of (hydroxyimino)(phenyl)acetonitrile is 146.14600. |
| Q: What are the downstream products of (hydroxyimino)(phenyl)acetonitrile? |
| A: Related downstream products(CAS) of (hydroxyimino)(phenyl)acetonitrile: 5728-14-3;59577-32-1;5398-63-0;613-89-8;17512-88-8;16750-42-8;10543-64-3;5700-56-1. |
| Q: What is the CAS number of (hydroxyimino)(phenyl)acetonitrile? |
| A: CAS number of (hydroxyimino)(phenyl)acetonitrile is 825-52-5. |
| Q: What is the English name of (hydroxyimino)(phenyl)acetonitrile? |
| A: The English name of (hydroxyimino)(phenyl)acetonitrile is (hydroxyimino)(phenyl)acetonitrile. |
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. |