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Name |
Bicyclo[2.2.1]heptane-2-carboxylicacid, 3-amino- |
EINECS | N/A |
CAS No. | 76198-36-2 | Density | 1.241 g/cm3 |
PSA | 63.32000 | LogP | 1.14470 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H13NO2 | Boiling Point | 303.4 °C at 760 mmHg |
Molecular Weight | 155.197 | Flash Point | 137.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Norbornanecarboxylicacid, 3-amino- (6CI);3-Aminobicyclo[2.2.1]heptane-2-carboxylic acid; |
The Bicyclo[2.2.1]heptane-2-carboxylicacid, 3-amino-, with the CAS registry number 76198-36-2, is also known as 3-Amino-2-norbornanecarboxylic acid. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C8H13NO2 and molecular weight is 155.1943. What's more, both its IUPAC name and systematic name are the same which is called 3-Aminobicyclo[2.2.1]heptane-2-carboxylic acid.
Physical properties about Bicyclo[2.2.1]heptane-2-carboxylicacid, 3-amino- are: (1)ACD/LogP: 0.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.4; (4)ACD/LogD (pH 7.4): -2.39; (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: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 39.99 cm3; (15)Molar Volume: 125 cm3; (16)Polarizability: 15.85×10-24 cm3; (17)Surface Tension: 51.6 dyne/cm; (18)Density: 1.241 g/cm3; (19)Flash Point: 137.3 °C; (20)Enthalpy of Vaporization: 59.8 kJ/mol; (21)Boiling Point: 303.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000216 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C2C1CCC(C1)C2N
(2) InChI: InChI=1/C8H13NO2/c9-7-5-2-1-4(3-5)6(7)8(10)11/h4-7H,1-3,9H2,(H,10,11)
(3) InChIKey: JSYLGUSANAWARQ-UHFFFAOYAZ