Products Categories
| CAS No.: | 25978-74-9 |
|---|---|
| Name: | METHYL 3-CYANO-4-METHOXYBENZOATE |
| Article Data: | 7 |
| Molecular Structure: | |
|
|
|
| Formula: | C10H9NO3 |
| Molecular Weight: | 191.186 |
| Synonyms: | p-Anisic acid, 3-cyano-, methyl ester (8CI);3-Cyano-4-methoxybenzoic acid methyl ester;Methyl 3-cyano-4-methoxybenzoate; |
| EINECS: | -0 |
| Density: | 1.2 g/cm3 |
| Melting Point: | 124 °C |
| Boiling Point: | 339.7 °C at 760 mmHg |
| Flash Point: | 148.2 °C |
| Appearance: | light brown solid |
| Hazard Symbols: | R20/22:Harmful by inhalation and if swallowed.; |
| Risk Codes: | 20/21/22-36/37/38 |
| Safety: | 26-36/37/39 |
| Transport Information: | 3439 |
| PSA: | 59.32000 |
| LogP: | 1.35348 |
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- Total:32 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
This chemical is called Benzoic acid, 3-cyano-4-methoxy-, methyl ester, and its systematic name is Methyl 3-cyano-4-methoxybenzoate. With the CAS registry number of 25978-74-9, its product category is Aromatic Esters. In addition, this chemical should be sealed in the cool and dry plcace, away from oxides.
Other characteristics of the Benzoic acid, 3-cyano-4-methoxy-, methyl ester can be summarised as followings: (1)ACD/LogP: 2.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.19; (4)ACD/LogD (pH 7.4): 2.19; (5)ACD/BCF (pH 5.5): 27.08; (6)ACD/BCF (pH 7.4): 27.08; (7)ACD/KOC (pH 5.5): 369.06; (8)ACD/KOC (pH 7.4): 369.06; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 59.32 Å2; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 48.79 cm3; (15)Molar Volume: 158.4 cm3; (16)Polarizability: 19.34×10-24cm3; (17)Surface Tension: 47.2 dyne/cm; (18)Density: 1.2 g/cm3; (19)Flash Point: 148.2 °C; (20)Enthalpy of Vaporization: 58.32 kJ/mol; (21)Boiling Point: 339.7 °C at 760 mmHg; (22)Vapour Pressure: 9.03E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC)c1ccc(OC)c(C#N)c1
2.InChI: InChI=1/C10H9NO3/c1-13-9-4-3-7(10(12)14-2)5-8(9)6-11/h3-5H,1-2H3
3.InChIKey: RYJSFYBJYKFNCF-UHFFFAOYAD