2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole

C182H152F9N11 — CID 155216503

IUPAC2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole
SMILESCC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)Cc3cc4c5ccccc5n(-c5cc(-c6cccc(-c7ccccc7)n6)cc(-n6c7ccccc7c7ccc(-n8c9ccccc9c9ccccc98)cc76)c5C(F)(F)F)c4cc3-n3c4ccccc4c4ccccc43)ccc1n2-c1cc(-c2cccc(-c3ccccc3)n2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)Cc4cc(C(C)(C)C)cc5c4c4ccc(C(C)(C)C)cc4n5-c4cc(-c5cccc(-c6ccccc6)n5)cc(-n5c6cc(C(C)(C)C)ccc6c6ccc(C(C)(C)C)cc65)c4C(F)(F)F)ccc32)c1C(F)(F)F
InChIInChI=1S/C182H152F9N11/c1-172(2,3)115-74-83-151-135(95-115)137-97-120(178(19,20)105-113-88-134-129-58-37-43-70-150(129)200(160(134)104-155(113)196-147-67-40-34-55-126(147)127-56-35-41-68-148(127)196)165-92-111(143-63-45-60-140(193-143)108-49-28-24-29-50-108)91-164(170(165)181(186,187)188)199-149-69-42-36-57-128(149)132-82-78-123(103-159(132)199)195-145-65-38-32-53-124(145)125-54-33-39-66-146(125)195)76-85-153(137)197(151)162-89-110(142-62-44-59-139(192-142)107-47-26-23-27-48-107)90-163(169(162)180(183,184)185)198-152-84-75-116(173(4,5)6)96-136(152)138-98-121(77-86-154(138)198)179(21,22)106-114-87-122(177(16,17)18)102-161-168(114)133-81-73-119(176(13,14)15)101-158(133)202(161)167-94-112(144-64-46-61-141(194-144)109-51-30-25-31-52-109)93-166(171(167)182(189,190)191)201-156-99-117(174(7,8)9)71-79-130(156)131-80-72-118(100-157(131)201)175(10,11)12/h23-104H,105-106H2,1-22H3
InChIKeyBNIMMIRWINLFCF-UHFFFAOYSA-N
MW2664.28 g/mol
LogP50.53
Rot. Bonds20

About 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole

2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole (PubChem CID 155216503) has the molecular formula C182H152F9N11 and a molecular weight of 2664.28 g/mol. Its IUPAC name is 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole.

Molecular Properties

Compound Name2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole
PubChem CID155216503
Molecular FormulaC182H152F9N11
Molecular Weight2664.28 g/mol
Exact Mass2662.21
IUPAC Name2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole
SMILESCC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)Cc3cc4c5ccccc5n(-c5cc(-c6cccc(-c7ccccc7)n6)cc(-n6c7ccccc7c7ccc(-n8c9ccccc9c9ccccc98)cc76)c5C(F)(F)F)c4cc3-n3c4ccccc4c4ccccc43)ccc1n2-c1cc(-c2cccc(-c3ccccc3)n2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)Cc4cc(C(C)(C)C)cc5c4c4ccc(C(C)(C)C)cc4n5-c4cc(-c5cccc(-c6ccccc6)n5)cc(-n5c6cc(C(C)(C)C)ccc6c6ccc(C(C)(C)C)cc65)c4C(F)(F)F)ccc32)c1C(F)(F)F
InChIInChI=1S/C182H152F9N11/c1-172(2,3)115-74-83-151-135(95-115)137-97-120(178(19,20)105-113-88-134-129-58-37-43-70-150(129)200(160(134)104-155(113)196-147-67-40-34-55-126(147)127-56-35-41-68-148(127)196)165-92-111(143-63-45-60-140(193-143)108-49-28-24-29-50-108)91-164(170(165)181(186,187)188)199-149-69-42-36-57-128(149)132-82-78-123(103-159(132)199)195-145-65-38-32-53-124(145)125-54-33-39-66-146(125)195)76-85-153(137)197(151)162-89-110(142-62-44-59-139(192-142)107-47-26-23-27-48-107)90-163(169(162)180(183,184)185)198-152-84-75-116(173(4,5)6)96-136(152)138-98-121(77-86-154(138)198)179(21,22)106-114-87-122(177(16,17)18)102-161-168(114)133-81-73-119(176(13,14)15)101-158(133)202(161)167-94-112(144-64-46-61-141(194-144)109-51-30-25-31-52-109)93-166(171(167)182(189,190)191)201-156-99-117(174(7,8)9)71-79-130(156)131-80-72-118(100-157(131)201)175(10,11)12/h23-104H,105-106H2,1-22H3
InChIKeyBNIMMIRWINLFCF-UHFFFAOYSA-N
XLogP50.53
TPSA78.11 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds20
Heavy Atoms202
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002664.28
LogP ≤ 550.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole?
The IUPAC name of 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole (CID 155216503) is 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole.
What is the SMILES notation for 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole?
The canonical SMILES for 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole is CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)Cc3cc4c5ccccc5n(-c5cc(-c6cccc(-c7ccccc7)n6)cc(-n6c7ccccc7c7ccc(-n8c9ccccc9c9ccccc98)cc76)c5C(F)(F)F)c4cc3-n3c4ccccc4c4ccccc43)ccc1n2-c1cc(-c2cccc(-c3ccccc3)n2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)Cc4cc(C(C)(C)C)cc5c4c4ccc(C(C)(C)C)cc4n5-c4cc(-c5cccc(-c6ccccc6)n5)cc(-n5c6cc(C(C)(C)C)ccc6c6ccc(C(C)(C)C)cc65)c4C(F)(F)F)ccc32)c1C(F)(F)F.
What is the InChIKey of 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole?
The InChIKey is BNIMMIRWINLFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C182H152F9N11/c1-172(2,3)115-74-83-151-135(95-115)137-97-120(178(19,20)105-113-88-134-129-58-37-43-70-150(129)200(160(134)104-155(113)196-147-67-40-34-55-126(147)127-56-35-41-68-148(127)196)165-92-111(143-63-45-60-140(193-143)108-49-28-24-29-50-108)91-164(170(165)181(186,187)188)199-149-69-42-36-57-128(149)132-82-78-123(103-159(132)199)195-145-65-38-32-53-124(145)125-54-33-39-66-146(125)195)76-85-153(137)197(151)162-89-110(142-62-44-59-139(192-142)107-47-26-23-27-48-107)90-163(169(162)180(183,184)185)198-152-84-75-116(173(4,5)6)96-136(152)138-98-121(77-86-154(138)198)179(21,22)106-114-87-122(177(16,17)18)102-161-168(114)133-81-73-119(176(13,14)15)101-158(133)202(161)167-94-112(144-64-46-61-141(194-144)109-51-30-25-31-52-109)93-166(171(167)182(189,190)191)201-156-99-117(174(7,8)9)71-79-130(156)131-80-72-118(100-157(131)201)175(10,11)12/h23-104H,105-106H2,1-22H3.
What are the key properties of 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole?
2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole has a molecular weight of 2664.28 g/mol, XLogP of 50.53, 20 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[2-carbazol-9-yl-9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)-2-(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 155216503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).