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Name |
1,4,9,10-Anthracenetetrol,6,7-dichloro- |
EINECS | 233-455-0 |
CAS No. | 10183-49-0 | Density | 1.774 g/cm3 |
PSA | 0.00000 | LogP | 0.00000 |
Solubility | N/A | Melting Point |
N/A |
Formula | C14H8Cl2O4 | Boiling Point | 685.1 °C at 760 mmHg |
Molecular Weight | 311.1169 | Flash Point | 368.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
6,7-Dichloro-1,4,9,10-anthracenetetrol; |
The 1,4,9,10-Anthracenetetrol,6,7-dichloro-, with the CAS registry number 10183-49-0, is also known as 6,7-Dichloro-1,4,9,10-anthracenetetrol. Its EINECS registry number is 233-455-0. This chemical's molecular formula is C14H8Cl2O4 and molecular weight is 311.1169. What's more, both its IUPAC name and systematic name are the same which is 6,7-Dichloroanthracene-1,4,9,10-tetrol.
Physical properties about 1,4,9,10-Anthracenetetrol,6,7-dichloro- are: (1)ACD/LogP: 2.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.53; (4)ACD/LogD (pH 7.4): 2.17; (5)ACD/BCF (pH 5.5): 49.32; (6)ACD/BCF (pH 7.4): 21.35; (7)ACD/KOC (pH 5.5): 564.3; (8)ACD/KOC (pH 7.4): 244.29; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 36.92 Å2; (13)Index of Refraction: 1.864; (14)Molar Refractivity: 79.25 cm3; (15)Molar Volume: 175.2 cm3; (16)Polarizability: 31.41×10-24 cm3; (17)Surface Tension: 94.6 dyne/cm; (18)Density: 1.774 g/cm3; (19)Flash Point: 368.1 °C; (20)Enthalpy of Vaporization: 104.08 kJ/mol; (21)Boiling Point: 685.1 °C at 760 mmHg; (22)Vapour Pressure: 2.12E-19 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc3cc2c(O)c1c(O)ccc(O)c1c(O)c2cc3Cl
(2) InChI: InChI=1/C14H8Cl2O4/c15-7-3-5-6(4-8(7)16)14(20)12-10(18)2-1-9(17)11(12)13(5)19/h1-4,17-20H
(3) InChIKey: JKHMZJNNKYIWNR-UHFFFAOYAN