3-Pyridinecarboxylicacid, 2-[(2-aminoethyl)amino]- supplier

Name
2-[(2-AMINOETHYL)AMINO]NICOTINIC ACID
EINECS
CAS No. 374063-93-1
Density 1.343 g/cm³
Solubility
Melting Point
Formula C₈H₁₁N₃O₂
Boiling Point 415.2 °C at 760 mmHg
Molecular Weight 181.19
Flash Point 204.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-[(2-aminoethyl)amino]pyridine-3-carboxylic acid;3-pyridinecarboxylic acid, 2-[(2-aminoethyl)amino]-;2-[(2-aminoethyl)amino]pyridine-3-carboxylic acid;
PSA 88.24000
LogP 0.92370

3-Pyridinecarboxylicacid, 2-[(2-aminoethyl)amino]- Specification

The 3-Pyridinecarboxylicacid, 2-[(2-aminoethyl)amino]-, with the CAS registry number 374063-93-1, has the systematic name of 2-[(2-aminoethyl)amino]pyridine-3-carboxylic acid. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₈H₁₁N₃O₂.

The characteristics of 3-Pyridinecarboxylicacid, 2-[(2-aminoethyl)amino]- are as followings: (1)ACD/LogP: 0.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.77; (4)ACD/LogD (pH 7.4): -1.7; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 45.67 Å²; (13)Index of Refraction: 1.647; (14)Molar Refractivity: 49.05 cm³; (15)Molar Volume: 134.8 cm³; (16)Polarizability: 19.44×10^-24cm³; (17)Surface Tension: 70.9 dyne/cm; (18)Density: 1.343 g/cm³; (19)Flash Point: 204.9 °C; (20)Enthalpy of Vaporization: 70.45 kJ/mol; (21)Boiling Point: 415.2 °C at 760 mmHg; (22)Vapour Pressure: 1.23E-07 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)c1cccnc1NCCN
(2)InChI: InChI=1/C8H11N3O2/c9-3-5-11-7-6(8(12)13)2-1-4-10-7/h1-2,4H,3,5,9H2,(H,10,11)(H,12,13)
(3)InChIKey: LENSCFWMQFKIIQ-UHFFFAOYAP

Product Name

2-[(2-AMINOETHYL)AMINO]NICOTINIC ACID

3-Pyridinecarboxylicacid, 2-[(2-aminoethyl)amino]- Specification

Related Products

Hot Products