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CAS No.: | 144246-02-6 |
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Name: | 4-Amino-N-2,4-xylyl-1,8-naphthalimide |
Molecular Structure: | |
Formula: | Unspecified |
Molecular Weight: | 316.35300 |
Synonyms: | Fluorescent Yellow FP; Solvent Yellow 135; |
Density: | 1.342 g/cm3 |
Boiling Point: | 591.4oC at 760 mmHg |
PSA: | 65.09000 |
LogP: | 3.72210 |
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The cas register number of 4-Amino-N-2,4-xylyl-1,8-naphthalimide is 144246-02-6. It also can be called as 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6-amino-2-(2,4-dimethylphenyl)- and the Systematic name about this chemical is 6-amino-2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione.
Physical properties about 4-Amino-N-2,4-xylyl-1,8-naphthalimide are: (1)ACD/LogP: 2.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.3; (4)ACD/LogD (pH 7.4): 2.57; (5)ACD/BCF (pH 5.5): 28.17; (6)ACD/BCF (pH 7.4): 52.77; (7)ACD/KOC (pH 5.5): 316.56; (8)ACD/KOC (pH 7.4): 593.08; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 40.62Å2; (13)Index of Refraction: 1.727; (14)Molar Refractivity: 93.81 cm3; (15)Molar Volume: 235.7 cm3; (16)Surface Tension: 66.2 dyne/cm; (17)Density: 1.342 g/cm3; (18)Flash Point: 311.5 °C; (19)Enthalpy of Vaporization: 88.21 kJ/mol; (20)Boiling Point: 591.4 °C at 760 mmHg; (21)Vapour Pressure: 5.85E-14 mmHg at 25°C.
People can use the following data to convert to the molecule structure.
1.SMILES: O=C3c1c4c(c(cc1)N)cccc4C(=O)N3c2ccc(cc2C)C
2.InChI: InChI=1/C20H16N2O2/c1-11-6-9-17(12(2)10-11)22-19(23)14-5-3-4-13-16(21)8-7-15(18(13)14)20(22)24/h3-10H,21H2,1-2H3
3.InChIKey: FQLZTPSAVDHUKS-UHFFFAOYAL
4.Std. InChI: InChI=1S/C20H16N2O2/c1-11-6-9-17(12(2)10-11)22-19(23)14-5-3-4-13-16(21)8-7-15(18(13)14)20(22)24/h3-10H,21H2,1-2H3