5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide

C114H72N3O3P3 — CID 158880248

IUPAC5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
SMILESO=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc2ccccc2c2ccccc12.O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2c(ccc3ccccc32)c1.O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2c1ccc1ccccc12
InChIInChI=1S/3C38H24NOP/c40-41(26-12-2-1-3-13-26)37-20-9-7-16-31(37)33-23-36-32(24-38(33)41)29-15-6-8-18-34(29)39(36)35-19-10-17-28-27-14-5-4-11-25(27)21-22-30(28)35;40-41(28-11-2-1-3-12-28)37-17-9-7-15-32(37)34-23-36-33(24-38(34)41)31-14-6-8-16-35(31)39(36)27-20-21-30-26(22-27)19-18-25-10-4-5-13-29(25)30;40-41(26-13-2-1-3-14-26)37-21-11-9-19-31(37)33-23-36-32(24-38(33)41)30-18-8-10-20-34(30)39(36)35-22-25-12-4-5-15-27(25)28-16-6-7-17-29(28)35/h3*1-24H
InChIKeyJCYDLABQEMWCII-UHFFFAOYSA-N
MW1624.77 g/mol
LogP26.13
Rot. Bonds6

About 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide

5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide (PubChem CID 158880248) has the molecular formula C114H72N3O3P3 and a molecular weight of 1624.77 g/mol. Its IUPAC name is 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide.

Molecular Properties

Compound Name5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
PubChem CID158880248
Molecular FormulaC114H72N3O3P3
Molecular Weight1624.77 g/mol
Exact Mass1623.48
IUPAC Name5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
SMILESO=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc2ccccc2c2ccccc12.O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2c(ccc3ccccc32)c1.O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2c1ccc1ccccc12
InChIInChI=1S/3C38H24NOP/c40-41(26-12-2-1-3-13-26)37-20-9-7-16-31(37)33-23-36-32(24-38(33)41)29-15-6-8-18-34(29)39(36)35-19-10-17-28-27-14-5-4-11-25(27)21-22-30(28)35;40-41(28-11-2-1-3-12-28)37-17-9-7-15-32(37)34-23-36-33(24-38(34)41)31-14-6-8-16-35(31)39(36)27-20-21-30-26(22-27)19-18-25-10-4-5-13-29(25)30;40-41(26-13-2-1-3-14-26)37-21-11-9-19-31(37)33-23-36-32(24-38(33)41)30-18-8-10-20-34(30)39(36)35-22-25-12-4-5-15-27(25)28-16-6-7-17-29(28)35/h3*1-24H
InChIKeyJCYDLABQEMWCII-UHFFFAOYSA-N
XLogP26.13
TPSA66.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms123
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001624.77
LogP ≤ 526.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide with MolForge

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Related Compounds

5,11-diphenylphosphindolo[3,2-b]carbazole 11-oxide;5-naphthalen-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-naphthalen-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;11-phenyl-5-(2-phenylphenyl)phosphindolo[3,2-b]carbazole 11-oxide
CID 158937555
11-phenyl-5-quinolin-8-ylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310218
5,11-dinaphthalen-1-ylindolo[3,2-b]carbazole;11-naphthalen-1-yl-5-naphthalen-2-ylindolo[3,2-b]carbazole;11-naphthalen-1-yl-5-phenylindolo[3,2-b]carbazole;11-naphthalen-2-yl-5-phenylindolo[3,2-b]carbazole;11-phenanthren-2-yl-5-phenylindolo[3,2-b]carbazole;11-phenanthren-9-yl-5-phenylindolo[3,2-b]carbazole
CID 158059321
5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310284
5-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310256
5-[4-(9,9-dimethyl-7-naphthalen-1-ylfluoren-2-yl)phenyl]-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310310
11-phenyl-5-(4-quinolin-7-ylphenyl)phosphindolo[3,2-b]carbazole 11-oxide
CID 121310222
5-(7,10-diphenylfluoranthen-8-yl)-11-phenylphosphindolo[3,2-b]carbazole 11-oxide
CID 121310337
N-[4-[4-(11-oxo-11-phenylphosphindolo[3,2-b]carbazol-5-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 121310285
5-chrysen-3-yl-12-phenylphosphindolo[3,2-c]carbazole 12-oxide
CID 121310710
5,7-bis(9-phenylcarbazol-3-yl)phosphindolo[2,3-b]carbazole 7-oxide
CID 89472173
11-naphthalen-1-yl-12-phenylphosphindolo[2,3-a]carbazole 12-oxide
CID 121310385

Frequently Asked Questions

What is the IUPAC name of 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide?
The IUPAC name of 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide (CID 158880248) is 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide.
What is the SMILES notation for 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide?
The canonical SMILES for 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide is O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc2ccccc2c2ccccc12.O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2c(ccc3ccccc32)c1.O=P1(c2ccccc2)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2c1ccc1ccccc12.
What is the InChIKey of 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide?
The InChIKey is JCYDLABQEMWCII-UHFFFAOYSA-N. The full InChI is InChI=1S/3C38H24NOP/c40-41(26-12-2-1-3-13-26)37-20-9-7-16-31(37)33-23-36-32(24-38(33)41)29-15-6-8-18-34(29)39(36)35-19-10-17-28-27-14-5-4-11-25(27)21-22-30(28)35;40-41(28-11-2-1-3-12-28)37-17-9-7-15-32(37)34-23-36-33(24-38(34)41)31-14-6-8-16-35(31)39(36)27-20-21-30-26(22-27)19-18-25-10-4-5-13-29(25)30;40-41(26-13-2-1-3-14-26)37-21-11-9-19-31(37)33-23-36-32(24-38(33)41)30-18-8-10-20-34(30)39(36)35-22-25-12-4-5-15-27(25)28-16-6-7-17-29(28)35/h3*1-24H.
What are the key properties of 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide?
5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide has a molecular weight of 1624.77 g/mol, XLogP of 26.13, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenanthren-1-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-2-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide;5-phenanthren-9-yl-11-phenylphosphindolo[3,2-b]carbazole 11-oxide is sourced from PubChem (CID 158880248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).