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6451-12-3 | [2,2'-Bianthra[2,1-d]thiazole]-6,6',11,11'-tetrone
CAS No: 6451-12-3 Catalog No: AG00EPBN MDL No:
Product Description
Catalog Number:
AG00EPBN
Chemical Name:
[2,2'-Bianthra[2,1-d]thiazole]-6,6',11,11'-tetrone
CAS Number:
6451-12-3
IUPAC Name:
2-(6,11-dioxonaphtho[2,3-g][1,3]benzothiazol-2-yl)naphtho[2,3-g][1,3]benzothiazole-6,11-dione
InChI:
InChI=1S/C30H12N2O4S2/c33-23-13-5-1-3-7-15(13)25(35)21-17(23)9-11-19-27(21)37-29(31-19)30-32-20-12-10-18-22(28(20)38-30)26(36)16-8-4-2-6-14(16)24(18)34/h1-12H
InChI Key:
VYPILCHHNHVAAE-UHFFFAOYSA-N
EC Number:
229-252-1
Properties
Complexity:
985
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
528.024g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
528.556g/mol
Monoisotopic Mass:
528.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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