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2172-33-0

Basic Information
CAS No.: 2172-33-0
Name: Vat Orange 11
Molecular Structure:
Molecular Structure of 2172-33-0 (Vat Orange 11)
Formula: C42H18N2O6
Molecular Weight: 646.615
Synonyms: Benzo[1,2-i,4,5-i']bisnaphtho[2,3-a]carbazole-5,7,12,17,19,24-hexone,6,18-dihydro- (5CI);Dinaphtho[2,3-i:2',3'-i']benzo[1,2-a:4,5-a']dicarbazole-5,7,12,17,19,24(6H,18H)-(6CI);Benzadone Yellow 3RT;Bis[anthraquinone(2,3-b)pyrrolo][2,3,2',3'-b,b']anthraquinone;C.I. 70805;C.I. Vat Orange 11:1;Carbanthrene Yellow 3R;Cibanone Yellow F 3R;Cibanone Yellow F 3RF;Indanthren Yellow 3RT;IndanthreneYellow 3RT;Mikethrene Yellow 3RT;Navinon Yellow 3RTSD;Paradone Yellow 3RT;Pernithrene Yellow 3RT;PonsolYellow 3R;Sandothrene Yellow N 3R;Tinon Yellow 3R-F;Dinaphtho[2,3-i:2',3'-i']benzo[1,2-a:4,5-a']dicarbazole-5,7,12,17,19,24(6H,18H)-hexone;Vat Yellow 3R;
EINECS: 218-524-5
Density: 1.651 g/cm3
Solubility: 1μg/L at 20℃
PSA: 134.00000
LogP: 7.28180
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Chemistry

Product Name: Dinaphtho[2,3-i:2',3'-i']benzo[1,2-a:4,5-a']dicarbazole-5,7,12,17,19,24(6H,18H)-hexone (CAS NO.2172-33-0)


Molecular Formula: C42H18N2O6
Molecular Weight: 646.61g/mol
Mol File: 2172-33-0.mol
EINECS: 218-524-5
Density: 1.651 g/cm3
Surface Tension: 99.4 dyne/cm
XLogP3-AA: 7.7
H-Bond Donor: 2
H-Bond Acceptor: 6
Structure Descriptors of Dinaphtho[2,3-i:2',3'-i']benzo[1,2-a:4,5-a']dicarbazole-5,7,12,17,19,24(6H,18H)-hexone (CAS NO.2172-33-0):
  Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)C5=C(N4)C6=C(C=C5)C(=O)C7=C(C6=O)C=CC8=C7NC9=C8C=CC1=C9C(=O)C2=CC=CC=C2C1=O
  InChI: InChI=1S/C42H18N2O6/c45-37-21-5-1-3-7-23(21)39(47)29-25(37)13-9-17-19-11-15-27-31(35(19)43-33(17)29)41(49)28-16-12-20-18-10-14-26-30(34(18)44-36(20)32(28)42(27)50)40(48)24-8-4-2-6-22(24)38(26)46/h1-16,43-44H 
  InChIKey: CVWSULASWLZVCH-UHFFFAOYSA-N
Product Categories: Organics

Specification

 Dinaphtho[2,3-i:2',3'-i']benzo[1,2-a:4,5-a']dicarbazole-5,7,12,17,19,24(6H,18H)-hexone , its CAS NO. is 2172-33-0, the synonyms are 6,18-Dihydrodinaphtho(2,3-i:2',3'-i')benzo(1,2-a:4,5-a')dicarbazole-5,7,12,17,19,24-hexone ; Dinaphtho(2,3-i:2',3'-i)benzo(1,2-a:4,5-a')dicarbazole-5,7,12,17,19,24-hexone, 6,18-dihydro- .