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10114-49-5

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Basic Information
CAS No.: 10114-49-5
Name: Solvent Red 207
Molecular Structure:
Molecular Structure of 10114-49-5 (Solvent Red 207)
Formula: C28H22 N2 O2
Molecular Weight: 418.495
Synonyms: Anthraquinone,1,5-di-m-toluidino- (7CI,8CI); 1,5-Bis[(3-methylphenyl)amino]anthraquinone;C.I. 617001; C.I. Solvent Red 207; Solvent Red 207
EINECS: 233-313-8
Density: 1.292 g/cm3
Melting Point: 198 °C
Boiling Point: 618.9 °C at 760 mmHg
Flash Point: 190.3 °C
PSA: 58.20000
LogP: 6.09720
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Chemistry

Molecular Structure of 1,5-Bis((3-methylphenyl)amino)anthraquinone (CAS NO.10114-49-5):

IUPAC Name: 1,5-Bis(3-methylanilino)anthracene-9,10-dione 
Molecular Formula: C28H22N2O2
Molecular Weight: 418.49
EINECS: 233-313-8 
XLogP3-AA: 7.8
H-Bond Donor: 2
H-Bond Acceptor: 4
Index of Refraction: 1.714
Molar Refractivity: 127.06 cm3
Molar Volume: 323.6 cm3
Surface Tension: 63 dyne/cm
Density: 1.292 g/cm3
Flash Point: 190.3 °C
Enthalpy of Vaporization: 91.75 kJ/mol
Boiling Point: 618.9 °C at 760 mmHg
Vapour Pressure: 3.03E-15 mmHg at 25 °C
Product Categories: Solvent Dyestuff
Canonical SMILES: CC1=CC(=CC=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=CC(=C5)C
InChI: InChI=1S/C28H22N2O2/c1-17-7-3-9-19(15-17)29-23-13-5-11-21-25(23)27(31)22-12-6-14-24(26(22)28(21)32)30-20-10-4-8-18(2)16-20/h3-16,29-30H,1-2H3
InChIKey: CKBFYMOTEJMJTP-UHFFFAOYSA-N

Specification

 1,5-Bis((3-methylphenyl)amino)anthraquinone (CAS NO.10114-49-5), its Synonyms are 9,10-Anthracenedione,1,5-bis[(3-methylphenyl)amino]- ; Solvent Red 207 ; Anthraquinone,1,5-di-m-toluidino- (7CI,8CI) ; C.I. 617001 .