Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(4S)-6-Methyl-4-phenylchroman-2-one |
EINECS | N/A |
CAS No. | 349547-18-8 | Density | 1.166 g/cm3 |
PSA | 26.30000 | LogP | 3.43600 |
Solubility | N/A | Melting Point |
N/A |
Formula | C16H14O2 | Boiling Point | 351.1 °C at 760 mmHg |
Molecular Weight | 238.286 | Flash Point | 146.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
6-Methyl-4-(S)-phenylchroman-2-one;(4S)-6-Methyl-4-phenylchroman-2-one; |
Article Data | 10 |
The (4S)-6-Methyl-4-phenylchroman-2-one with the cas number 349547-18-8 is also called 6-Methyl-4-(S)-phenylchroman-2-one. The systematic name is (4S)-6-methyl-4-phenyl-3,4-dihydro-2H-chromen-2-one. Its molecular formula is C16H14O2. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 3.64; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.595; (8)Molar Refractivity: 69.43 cm3; (9)Molar Volume: 204.2 cm3; (10)Polarizability: 27.52×10-24cm3; (11)Surface Tension: 44.6 dyne/cm; (12)Enthalpy of Vaporization: 59.58 kJ/mol; (13)Vapour Pressure: 4.2×10-5 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C3Oc1ccc(cc1[C@H](c2ccccc2)C3)C
(2)InChI: InChI=1/C16H14O2/c1-11-7-8-15-14(9-11)13(10-16(17)18-15)12-5-3-2-4-6-12/h2-9,13H,10H2,1H3/t13-/m0/s1
(3)InChIKey: SUHIZPDCJOQZLN-ZDUSSCGKBG