2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole

C19H10Br2F3N — CID 102260661

IUPAC2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole
SMILESFC(F)(F)c1ccc(-n2c3cc(Br)ccc3c3ccc(Br)cc32)cc1
InChIInChI=1S/C19H10Br2F3N/c20-12-3-7-15-16-8-4-13(21)10-18(16)25(17(15)9-12)14-5-1-11(2-6-14)19(22,23)24/h1-10H
InChIKeyOZSXFXZDRSBFIW-UHFFFAOYSA-N
MW469.10 g/mol
LogP7.33
Rot. Bonds1

About 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole

2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole (PubChem CID 102260661) has the molecular formula C19H10Br2F3N and a molecular weight of 469.10 g/mol. Its IUPAC name is 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole.

Molecular Properties

Compound Name2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole
PubChem CID102260661
Molecular FormulaC19H10Br2F3N
Molecular Weight469.10 g/mol
Exact Mass466.91
IUPAC Name2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole
SMILESFC(F)(F)c1ccc(-n2c3cc(Br)ccc3c3ccc(Br)cc32)cc1
InChIInChI=1S/C19H10Br2F3N/c20-12-3-7-15-16-8-4-13(21)10-18(16)25(17(15)9-12)14-5-1-11(2-6-14)19(22,23)24/h1-10H
InChIKeyOZSXFXZDRSBFIW-UHFFFAOYSA-N
XLogP7.33
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.10
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[4-bis[4-[2,7-bis(trifluoromethyl)carbazol-9-yl]phenyl]phosphorylphenyl]-2,7-bis(trifluoromethyl)carbazole
CID 138749634
2-bromo-9-(9-phenylcarbazol-2-yl)carbazole
CID 167514320
5-bromo-1-[4-(trifluoromethyl)phenyl]benzimidazol-2-amine
CID 43661954
9-(4-bromophenyl)-2-tert-butylcarbazole
CID 142745661
9-[4-[diphenyl-[4-[2-(trifluoromethyl)carbazol-9-yl]phenyl]methyl]phenyl]-2-(trifluoromethyl)carbazole
CID 90277489
9-[3,5-bis(trifluoromethyl)phenyl]carbazole;9-[3,5-bis(trifluoromethyl)phenyl]-3,6-dibromocarbazole;molecular bromine
CID 159441220
9-(4-bromophenyl)-3,6-ditert-butylcarbazole
CID 139082644
9-[5-[3-[2,7-bis[4-(trifluoromethyl)phenyl]carbazol-9-yl]-4-(trifluoromethyl)phenyl]-2-(trifluoromethyl)phenyl]-2,7-bis[4-(trifluoromethyl)phenyl]carbazole
CID 147940441
9-[4-(trifluoromethyl)phenyl]-3,6-ditritylcarbazole
CID 58479630
3-bromo-9-(4-tert-butylphenyl)-6-methylcarbazole
CID 91019320
2-bromo-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118587549
2-bromo-9-(4-naphthalen-1-ylphenyl)carbazole
CID 130250089

Frequently Asked Questions

What is the IUPAC name of 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole?
The IUPAC name of 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole (CID 102260661) is 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole.
What is the SMILES notation for 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole?
The canonical SMILES for 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole is FC(F)(F)c1ccc(-n2c3cc(Br)ccc3c3ccc(Br)cc32)cc1.
What is the InChIKey of 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole?
The InChIKey is OZSXFXZDRSBFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H10Br2F3N/c20-12-3-7-15-16-8-4-13(21)10-18(16)25(17(15)9-12)14-5-1-11(2-6-14)19(22,23)24/h1-10H.
What are the key properties of 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole?
2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole has a molecular weight of 469.10 g/mol, XLogP of 7.33, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dibromo-9-[4-(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 102260661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).