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Name |
Phenol,3-(3-iodo-2-methylpropyl)-, (R)- (9CI) |
EINECS | N/A |
CAS No. | 143239-04-7 | Density | 1.596 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H13IO | Boiling Point | 323.1 °C at 760 mmHg |
Molecular Weight | 276.117 | Flash Point | 149.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
CID178703; |
Article Data | 1 |
The Phenol,3-(3-iodo-2-methylpropyl)-, (R)- (9CI), with the CAS registry number 143239-04-7, is also known as CID178703. This chemical's molecular formula is C10H13IO and molecular weight is 276.11409. Its IUPAC name is called 3-[(2R)-3-iodo-2-methylpropyl]phenol.
Physical properties of Phenol,3-(3-iodo-2-methylpropyl)-, (R)- (9CI): (1)ACD/LogP: 3.51; (2)ACD/LogD (pH 5.5): 3.51; (3)ACD/LogD (pH 7.4): 3.51; (4)ACD/BCF (pH 5.5): 274.41; (5)ACD/BCF (pH 7.4): 273.7; (6)ACD/KOC (pH 5.5): 1936.45; (7)ACD/KOC (pH 7.4): 1931.47; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.609; (12)Molar Refractivity: 59.87 cm3; (13)Molar Volume: 172.8 cm3; (14)Surface Tension: 45.8 dyne/cm; (15)Density: 1.596 g/cm3; (16)Flash Point: 149.2 °C; (17)Enthalpy of Vaporization: 58.75 kJ/mol; (18)Boiling Point: 323.1 °C at 760 mmHg; (19)Vapour Pressure: 0.000142 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(CC1=CC(=CC=C1)O)CI
(2)Isomeric SMILES: C[C@H](CC1=CC(=CC=C1)O)CI
(3)InChI: InChI=1S/C10H13IO/c1-8(7-11)5-9-3-2-4-10(12)6-9/h2-4,6,8,12H,5,7H2,1H3/t8-/m1/s1
(4)InChIKey: ZAHQYHPWGLDSPB-MRVPVSSYSA-N