8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine

C33H26NP — CID 118668325

IUPAC8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine
SMILESCC1(C)c2ccccc2-c2c1ccc1c2P(c2ccccc2)c2ccccc2N1c1ccccc1
InChIInChI=1S/C33H26NP/c1-33(2)26-18-10-9-17-25(26)31-27(33)21-22-29-32(31)35(24-15-7-4-8-16-24)30-20-12-11-19-28(30)34(29)23-13-5-3-6-14-23/h3-22H,1-2H3
InChIKeyOWOLBWLQMOFASQ-UHFFFAOYSA-N
MW467.55 g/mol
LogP7.53
Rot. Bonds2

About 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine

8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine (PubChem CID 118668325) has the molecular formula C33H26NP and a molecular weight of 467.55 g/mol. Its IUPAC name is 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine.

Molecular Properties

Compound Name8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine
PubChem CID118668325
Molecular FormulaC33H26NP
Molecular Weight467.55 g/mol
Exact Mass467.18
IUPAC Name8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine
SMILESCC1(C)c2ccccc2-c2c1ccc1c2P(c2ccccc2)c2ccccc2N1c1ccccc1
InChIInChI=1S/C33H26NP/c1-33(2)26-18-10-9-17-25(26)31-27(33)21-22-29-32(31)35(24-15-7-4-8-16-24)30-20-12-11-19-28(30)34(29)23-13-5-3-6-14-23/h3-22H,1-2H3
InChIKeyOWOLBWLQMOFASQ-UHFFFAOYSA-N
XLogP7.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.55
LogP ≤ 57.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

5,5,31,31-tetramethyl-15,21,36-triphenyl-15,21,36-triaza-1-phosphadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6,8,10,12,16(35),17,19,22(34),23,25,27,29,32-pentadecaene
CID 134317509
6,6-dimethyl-9,15-diphenyl-1-aza-15-phosphaheptacyclo[14.10.1.02,14.05,13.07,12.020,27.021,26]heptacosa-2(14),3,5(13),7(12),8,10,16,18,20(27),21,23,25-dodecaene;6,6-dimethyl-3,9,15,18-tetraphenyl-1-aza-15-phosphaheptacyclo[14.10.1.02,14.05,13.07,12.020,27.021,26]heptacosa-2(14),3,5(13),7(12),8,10,16,18,20(27),21,23,25-dodecaene;6,6-dimethyl-3,9,15-triphenyl-1-aza-15-phosphaheptacyclo[14.10.1.02,14.05,13.07,12.020,27.021,26]heptacosa-2(14),3,5(13),7(12),8,10,16,18,20(27),21,23,25-dodecaene;5,6,8,8,13-pentakis-phenyl-3-(9-phenylcarbazol-3-yl)indeno[1,2-a]phenophosphazinine
CID 159789537
3-(9,9-dimethyl-10-phenylacridin-3-yl)-9,9-dimethyl-10-phenylacridine
CID 58489784
18-(9,9-dimethyl-10-phenylacridin-2-yl)-10,10,21,21-tetramethyl-14-phenyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaene
CID 118227857
30,30-dimethyl-11,16,22-triphenyl-11,16,22-triaza-1,4-diboranonacyclo[15.11.1.16,26.02,15.03,12.04,27.05,10.021,29.023,28]triaconta-2(15),3(12),5,7,9,13,17,19,21(29),23(28),24,26-dodecaene
CID 166568286
N-(9,9-dimethylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 135166847
4-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluorene
CID 166563569
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N,10-diphenylacridin-3-amine
CID 121258957
11,11,19,19-tetramethyl-15,26-diphenyl-15,26-diazaheptacyclo[14.12.0.02,14.04,12.05,10.018,27.020,25]octacosa-1(28),2,4(12),5,7,9,13,16,18(27),20,22,24-dodecaene
CID 66805110
1-[10-(9,9-dimethylfluoren-4-yl)-8-(9,9,10-triphenylacridin-1-yl)anthracen-1-yl]-9,9,10-triphenylacridine
CID 155334491
8,8,13,13-tetramethyl-5-phenyl-3-(3-pyridin-2-ylphenyl)indeno[1,2-a]acridine
CID 118668352
2-[9-(7,7-dimethylbenzo[c]fluoren-5-yl)-10-phenylanthracen-2-yl]-9,9-dimethyl-10-phenylacridine
CID 89024085

Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine?
The IUPAC name of 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine (CID 118668325) is 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine.
What is the SMILES notation for 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine?
The canonical SMILES for 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine is CC1(C)c2ccccc2-c2c1ccc1c2P(c2ccccc2)c2ccccc2N1c1ccccc1.
What is the InChIKey of 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine?
The InChIKey is OWOLBWLQMOFASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26NP/c1-33(2)26-18-10-9-17-25(26)31-27(33)21-22-29-32(31)35(24-15-7-4-8-16-24)30-20-12-11-19-28(30)34(29)23-13-5-3-6-14-23/h3-22H,1-2H3.
What are the key properties of 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine?
8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine has a molecular weight of 467.55 g/mol, XLogP of 7.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-5,13-diphenylindeno[1,2-a]phenophosphazinine is sourced from PubChem (CID 118668325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).