Benzoic acid,4-[(2-hydroxyethyl)amino]-3-nitro- supplier

Name
4-(2-HYDROXY-ETHYLAMINO)-3-NITRO-BENZOIC ACID
EINECS
CAS No. 59320-14-8
Article Data4
CAS DataBase
Density 1.535 g/cm³
Solubility
Melting Point 209 °C(Solv: water (7732-18-5))
Formula C₉H₁₀N₂O₅
Boiling Point 485.3 °C at 760 mmHg
Molecular Weight 226.189
Flash Point 247.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-[(2-Hydroxyethyl)amino]-3-nitrobenzoicacid;
PSA 115.38000
LogP 1.29340

Benzoic acid,4-[(2-hydroxyethyl)amino]-3-nitro- Specification

The Benzoic acid, 4-[(2-hydroxyethyl)amino]-3-nitro-, with the CAS registry number of 59320-14-8, is also known as 4-[(2-Hydroxyethyl)amino]-3-nitrobenzoicacid. This chemical's molecular formula is C₉H₁₀N₂O₅ and molecular weight is 226.1861. What's more, its systematic name is called 4-[(2-Hydroxyethyl)amino]-3-nitrobenzoic acid.

Physical properties about Benzoic acid, 4-[(2-hydroxyethyl)amino]-3-nitro- are: (1)ACD/LogP: 1.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.25; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 6.99; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 84.59 Å²; (12)Index of Refraction: 1.677; (13)Molar Refractivity: 55.5 cm³; (14)Molar Volume: 147.2 cm³; (15)Surface Tension: 79.8 dyne/cm; (16)Density: 1.535 g/cm³; (17)Flash Point: 247.3 °C; (18)Enthalpy of Vaporization: 79.08 kJ/mol; (19)Boiling Point: 485.3 °C at 760 mmHg; (20)Vapour Pressure: 3.13E-10 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c1cc(ccc1NCCO)C(=O)O
(2) InChI: InChI=1/C9H10N2O5/c12-4-3-10-7-2-1-6(9(13)14)5-8(7)11(15)16/h1-2,5,10,12H,3-4H2,(H,13,14)
(3) InChIKey: KRTQQHYYZBCHED-UHFFFAOYAA

Product Name

4-(2-HYDROXY-ETHYLAMINO)-3-NITRO-BENZOIC ACID

Benzoic acid,4-[(2-hydroxyethyl)amino]-3-nitro- Specification

Related Products

Hot Products