Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
N-(Adamantan-1-ylcarbonyl)glycine |
EINECS | N/A |
CAS No. | 21241-41-8 | Density | 1.279 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
195-198 °C |
Formula | C13H19NO3 | Boiling Point | 479.6 °C at 760 mmHg |
Molecular Weight | 237.297 | Flash Point | 243.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Glycine,N-(1-adamantylcarbonyl)- (8CI);N-(Adamantane-1-carbonyl)glycine;Glycine,N-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)-; |
Article Data | 8 |
The N-(Adamantan-1-ylcarbonyl)glycine, with the CAS registry number 21241-41-8, is also known as [(Adamantane-1-carbonyl)-amino]-acetic acid. This chemical's molecular formula is C13H19NO3 and molecular weight is 237.297. What's more, its systematic name is N-(Tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)glycine.
Physical properties about N-(Adamantan-1-ylcarbonyl)glycine are: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.67; (4)ACD/LogD (pH 7.4): -2.1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.08; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.61 Å2; (13)Index of Refraction: 1.573; (14)Molar Refractivity: 61.12 cm3; (15)Molar Volume: 185.4 cm3; (16)Polarizability: 24.23×10-24 cm3; (17)Surface Tension: 56.3 dyne/cm; (18)Density: 1.279 g/cm3; (19)Flash Point: 243.9 °C; (20)Enthalpy of Vaporization: 81.49 kJ/mol; (21)Boiling Point: 479.6 °C at 760 mmHg; (22)Vapour Pressure: 1.61E-10 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)CNC(=O)C13CC2CC(CC(C1)C2)C3
(2) InChI: InChI=1/C13H19NO3/c15-11(16)7-14-12(17)13-4-8-1-9(5-13)3-10(2-8)6-13/h8-10H,1-7H2,(H,14,17)(H,15,16)
(3) InChIKey: FGCTZJMAHLGRBY-UHFFFAOYAV