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CAS No.: | 90556-87-9 |
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Name: | 3-HYDRAZINO-BENZOIC ACID ETHYL ESTER |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C9H12N2O2 |
Molecular Weight: | 180.206 |
Synonyms: | Benzoicacid, 3-hydrazino-, ethyl ester (9CI);Benzoic acid, m-hydrazino-, ethyl ester(7CI);Ethyl 3-(hydrazino)benzoate; |
EINECS: | 604-604-1 |
Density: | 1.197 g/cm3 |
Boiling Point: | 330.4 °C at 760 mmHg |
Flash Point: | 153.6 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22 |
PSA: | 64.35000 |
LogP: | 1.92220 |
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The cas register number of Ethyl 3-hydrazinobenzoate is 90556-87-9. It also can be called as Benzoic acid,3-hydrazinyl-, ethyl ester and the IUPAC Name about this chemical is ethyl 3-hydrazinylbenzoate. It belongs to the pharmacetical.
Physical properties about Ethyl 3-hydrazinobenzoate are: (1)ACD/LogP: 2.11; (2)ACD/LogD (pH 5.5): 2.03; (3)ACD/LogD (pH 7.4): 2.11; (4)ACD/BCF (pH 5.5): 19.87; (5)ACD/BCF (pH 7.4): 23.54; (6)ACD/KOC (pH 5.5): 281.67; (7)ACD/KOC (pH 7.4): 333.64; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 64.35Å2; (12)Index of Refraction: 1.595; (13)Molar Refractivity: 51.17 cm3; (14)Molar Volume: 150.4 cm3; (15)Polarizability: 20.28x10-24cm3; (16)Surface Tension: 49.9 dyne/cm; (17)Enthalpy of Vaporization: 57.3 kJ/mol; (18)Vapour Pressure: 0.000167 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)C1=CC(=CC=C1)NN
(2)InChI: InChI=1S/C9H12N2O2/c1-2-13-9(12)7-4-3-5-8(6-7)11-10/h3-6,11H,2,10H2,1H3
(3)InChIKey: HAHYIMGJWDNBDK-UHFFFAOYSA-N