1,2-Bis[(3,6-dibromo-9H-carbazol-9-yl)methyl]benzene - CAS 222166-46-3
Catalog: |
BB073006 |
Product Name: |
1,2-Bis[(3,6-dibromo-9H-carbazol-9-yl)methyl]benzene |
CAS: |
222166-46-3 |
Synonyms: |
1,2-Bis[(3,6-dibromo-9H-carbazol-9-yl)methyl]benzene; 3,6-dibromo-9-[[2-[(3,6-dibromocarbazol-9-yl)methyl]phenyl]methyl]carbazole; 1,2-bis((3,6-dibromo-9H-carbazol-9-yl)methyl)benzene |
IUPAC Name: | 3,6-dibromo-9-[[2-[(3,6-dibromocarbazol-9-yl)methyl]phenyl]methyl]carbazole |
Description: | 1,2-Bis[(3,6-dibromo-9H-carbazol-9-yl)methyl]benzene is a reagent for the synthesis of methoxydiphenylamine substituted carbazole, an efficient hole transporting material for perovskite solar cells. |
Molecular Weight: | 752.13 |
Molecular Formula: | C32H20Br4N2 |
Canonical SMILES: | C1=CC=C(C(=C1)CN2C3=C(C=C(C=C3)Br)C4=C2C=CC(=C4)Br)CN5C6=C(C=C(C=C6)Br)C7=C5C=CC(=C7)Br |
InChI: | InChI=1S/C32H20Br4N2/c33-21-5-9-29-25(13-21)26-14-22(34)6-10-30(26)37(29)17-19-3-1-2-4-20(19)18-38-31-11-7-23(35)15-27(31)28-16-24(36)8-12-32(28)38/h1-16H,17-18H2 |
InChI Key: | ZHQHEWRIQYHYBQ-UHFFFAOYSA-N |
Complexity: | 709 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 751.8319 |
Formal Charge: | 0 |
Heavy Atom Count: | 38 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 747.836 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 9.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 10.7 |
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