| Identification | More | [Name]
4-Hydroxy-3-methoxybenzonitrile | [CAS]
4421-08-3 | [Synonyms]
4-HYDROXY-3-METHOXYBENZONITRILE
AKOS B004154
VANILLONITRILE
VANILO NITRILE
3-Methoxy-4-Hydroxybenzonitrile
3-Methoxy-4-Hydroxybenzonitril
4-Hydroxy-3-Methoxybenzonitile
3-Methoxy-4-Hydroxybenzonitrle | [EINECS(EC#)]
224-589-0 | [Molecular Formula]
C8H7NO2 | [MDL Number]
MFCD00001820 | [Molecular Weight]
149.15 | [MOL File]
4421-08-3.mol |
| Chemical Properties | Back Directory | [Appearance]
beige crystalline powder | [Melting point ]
85-87 °C (lit.) | [Boiling point ]
270.21°C (rough estimate) | [density ]
1.2517 (rough estimate) | [refractive index ]
1.5320 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [form ]
powder to crystal | [pka]
7.84±0.18(Predicted) | [color ]
White to Light yellow to Light orange | [InChI]
1S/C8H7NO2/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4,10H,1H3 | [InChIKey]
QJRWLNLUIAJTAD-UHFFFAOYSA-N | [SMILES]
COc1cc(ccc1O)C#N | [LogP]
1.551 (est) | [CAS DataBase Reference]
4421-08-3(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [RIDADR ]
3439 | [WGK Germany ]
3
| [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29269090 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
beige crystalline powder | [Uses]
4-Hydroxy-3-methoxybenzonitrile was used in the synthesis of 1,5-bis(4-cyano-2-methoxyphenoxy)-3-oxapentane. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 70, p. 2293, 1948 DOI: 10.1021/ja01186a514 | [General Description]
4-Hydroxy-3-methoxybenzonitrile on treatment with sodium perborate yields 4-hydroxy-3-methoxybenzamide. |
|
|