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6410-38-4

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Basic Information
CAS No.: 6410-38-4
Name: Pigment Red 9
Molecular Structure:
Molecular Structure of 6410-38-4 (Pigment Red 9)
Formula: C24H17Cl2N3O3
Molecular Weight: 466.323
Synonyms: 2-Naphth-o-anisidide,4-(2,5-dichlorophenylazo)-3-hydroxy- (6CI);2-Naphthalenecarboxamide,4-[(2,5-dichlorophenyl)azo]-3-hydroxy-N-(2-methoxyphenyl)- (9CI);C.I. PigmentRed 9 (7CI,8CI);Bright Red 4Zh;Brilliant Red 4Zh;C.I. 12460;IrgaliteScarlet GRL;Monolite Fast Red LF;Monolite Fast Red LFA;Monolite Fast RedLFD;Naftol Red RN 1522;Permanent Red FRLL;Pigment Brilliant Red 4Zh;PigmentRed RLL;Pigment red 9;Recolite Fast Red RLL;Segnale Light Red F 2L;SilosolRed GHN;Siloton Red FRLL;Syton Fast Red FRLL;Tinofil Scarlet GRL;
EINECS: 229-104-6
Density: 1.38
Boiling Point: 619.5 °C at 760 mmHg
Flash Point: 328.5 °C
Solubility: 1.6μg/L at 20℃
PSA: 83.28000
LogP: 7.60150
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Specification

The Pigment Red 9, with CAS registry number of 6410-38-4, has the systematic name of 4-(2,5-dichlorophenyl)azo-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide. The molecular formula is C24H17Cl2N3O3, and its product belongs to the category of Organics.

The characteristics of this chemical are as followings: (1)ACD/LogP: 7.17; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.17; (4)ACD/LogD (pH 7.4): 7.17; (5)#H bond acceptors: 6; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 83.28Å2; (9)Index of Refraction: 1.657; (10)Molar Refractivity: 124.23 cm3; (11)Molar Volume: 337.4 cm3; (12)Polarizability: 49.24×10-24cm3; (13)Surface Tension: 50.9 dyne/cm; (14)Density: 1.38 g/cm3; (15)Flash Point: 328.5 °C; (16)Enthalpy of Vaporization: 95.19 kJ/mol; (17)Boiling Point: 619.5 °C at 760 mmHg; (18)Vapour Pressure: 6.1E-16 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc4ccc(Cl)cc4N=Nc2c3ccccc3cc(C(=O)Nc1ccccc1OC)c2O
(2)InChI: InChI=1/C24H17Cl2N3O3/c1-32-21-9-5-4-8-19(21)27-24(31)17-12-14-6-2-3-7-16(14)22(23(17)30)29-28-20-13-15(25)10-11-18(20)26/h2-13,30H,1H3,(H,27,31)
(3)InChIKey: IBVDQFFVBKPVPB-UHFFFAOYAC