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2379-77-3

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Basic Information
CAS No.: 2379-77-3
Name: Vat Red 32
Article Data: 9
Molecular Structure:
Molecular Structure of 2379-77-3 (Vat Red 32)
Formula: C36H16Cl2N2O4
Molecular Weight: 611.44
Synonyms: 3,4,9,10-Perylenetetracarboxylic3,4:9,10-diimide, N,N'-bis(p-chlorophenyl)- (7CI,8CI);2,9-Bis(4-chlorophenyl)anthra[2,1,9-def:6,5,10-d'e'f]diisoquinoline-1,3,8,10(2H,9H)-tetraone;Algol Scarlet B;C.I. 71135;C.I. Pigment Red 189;C.I. Vat Red 32;FenanthrenScarlet RB;Indanthren Brilliant Red FFB;Indanthren Brilliant Red LGG;Indanthrene Scarlet RBA;N,N'-Bis(p-chlorophenyl)perylene-3,4,9,10-tetracarboxylic 3,4:9,10-diimide;Paliogen Red 3730;Pigment Red 189;Ponsol Scarlet RX;
EINECS: 219-166-2
Density: 1.632 g/cm3
Solubility: 31.68ng/L at 20℃
Appearance: Dark Red Powder
PSA: 78.14000
LogP: 7.24820
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Specification

The Vat Red 32 with cas registry number of 2379-77-3, is also called 3,4,9,10-Perylenetetracarboxylic3,4:9,10-diimide, N,N'-bis(p-chlorophenyl)- (7CI,8CI); Algol Scarlet B. The Vat Red 32 belongs to the following product categories: (1)Organics; (2)electronic.

Physical properties of Vat Red 32: (1)ACD/LogP: 6.57; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 6.57; (4)ACD/LogD (pH 7.4): 6.57; (5)ACD/BCF (pH 5.5): 57778.84; (6)ACD/BCF (pH 7.4): 57795.14; (7)ACD/KOC (pH 5.5): 89129.27; (8)ACD/KOC (pH 7.4): 89154.41; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 74.76 Å2; (13)Index of Refraction: 1.881; (14)Molar Refractivity: 171.76 cm3; (15)Molar Volume: 374.6 cm3; (16)Polarizability: 68.09×10-24cm3; (17)Surface Tension: 87.5 dyne/cm.

You can still convert the following datas into molecular structure: (1)SMILES:Clc1ccc(cc1)N3C(=O)c9c2c8c(ccc2C3=O)c4ccc7c5c4c(ccc5C(=O)N(c6ccc(Cl)cc6)C7=O)c8cc9; (2)InChI:InChI=1/C36H16Cl2N2O4/c37-17-1-5-19(6-2-17)39-33(41)25-13-9-21-23-11-15-27-32-28(36(44)40(35(27)43)20-7-3-18(38)4-8-20)16-12-24(30(23)32)22-10-14-26(34(39)42)31(25)29(21)22/h1-16H; (3)InChIKey:ILYBWLBYEIZMCE-UHFFFAOYAE; (4)Std. InChI:InChI=1S/C36H16Cl2N2O4/c37-17-1-5-19(6-2-17)39-33(41)25-13-9-21-23-11-15-27-32-28(36(44)40(35(27)43)20-7-3-18(38)4-8-20)16-12-24(30(23)32)22-10-14-26(34(39)42)31(25)29(21)22/h1-16H; (5)Std. InChIKey:ILYBWLBYEIZMCE-UHFFFAOYSA-N.