hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene

C62H50N2 — CID 142343119

IUPAChydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene
SMILESCc1ccccc1.NN.c1ccc(-c2cccc(CCc3cccc4c3-c3cc(-c5cc6ccccc6c6ccccc56)cc(-c5cc6ccccc6c6ccccc56)c3C4)c2)cc1
InChIInChI=1S/C55H38.C7H8.H4N2/c1-2-15-37(16-3-1)39-20-12-14-36(30-39)28-29-38-19-13-21-42-33-53-52(51-32-41-18-5-7-23-45(41)47-25-9-11-27-49(47)51)34-43(35-54(53)55(38)42)50-31-40-17-4-6-22-44(40)46-24-8-10-26-48(46)50;1-7-5-3-2-4-6-7;1-2/h1-27,30-32,34-35H,28-29,33H2;2-6H,1H3;1-2H2
InChIKeyULIDOKRRQNGEBK-UHFFFAOYSA-N
MW823.10 g/mol
LogP15.47
Rot. Bonds6

About hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene

hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene (PubChem CID 142343119) has the molecular formula C62H50N2 and a molecular weight of 823.10 g/mol. Its IUPAC name is hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene.

Molecular Properties

Compound Namehydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene
PubChem CID142343119
Molecular FormulaC62H50N2
Molecular Weight823.10 g/mol
Exact Mass822.40
IUPAC Namehydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene
SMILESCc1ccccc1.NN.c1ccc(-c2cccc(CCc3cccc4c3-c3cc(-c5cc6ccccc6c6ccccc56)cc(-c5cc6ccccc6c6ccccc56)c3C4)c2)cc1
InChIInChI=1S/C55H38.C7H8.H4N2/c1-2-15-37(16-3-1)39-20-12-14-36(30-39)28-29-38-19-13-21-42-33-53-52(51-32-41-18-5-7-23-45(41)47-25-9-11-27-49(47)51)34-43(35-54(53)55(38)42)50-31-40-17-4-6-22-44(40)46-24-8-10-26-48(46)50;1-7-5-3-2-4-6-7;1-2/h1-27,30-32,34-35H,28-29,33H2;2-6H,1H3;1-2H2
InChIKeyULIDOKRRQNGEBK-UHFFFAOYSA-N
XLogP15.47
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500823.10
LogP ≤ 515.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

1-(3-methyl-4-phenylnaphthalen-2-yl)-9H-fluorene
CID 87557291
9-(3-methyl-5-phenylphenyl)phenanthrene
CID 156682596
[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenanthren-9-ylphenyl]phenyl]methanamine
CID 142555574
anthracene;1,3-diphenylbenzene;bis(9H-fluorene);methane;naphthalene;phenanthrene;triphenylene;1,4-xylene
CID 159089276
1-methyl-3-phenylbenzene;2-[1-(4-methylphenyl)naphthalen-2-yl]phenanthrene;phenylmethanamine
CID 142592974
10-phenanthren-9-yl-9-(3-phenanthren-9-ylphenyl)-2-phenylanthracene
CID 58322788
9-[3-[6-(6-phenanthren-9-ylnaphthalen-2-yl)naphthalen-2-yl]phenyl]phenanthrene;9-[3-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]phenyl]phenanthrene
CID 158676895
2-[3-[1-[3-(4-phenylphenyl)phenyl]-9H-fluoren-3-yl]phenyl]triphenylene
CID 159018223
9-[3-methyl-5-(3-methyl-5-phenanthren-9-ylphenyl)phenyl]phenanthrene;9-[3-(4-naphthalen-2-ylphenyl)phenyl]phenanthrene;9-[4-(3-naphthalen-2-ylphenyl)phenyl]phenanthrene;3-[3-(4-phenanthren-9-ylphenyl)phenyl]phenanthrene;9-[3-(3-phenanthren-9-ylphenyl)phenyl]phenanthrene;9-[3-(4-phenanthren-9-ylphenyl)phenyl]phenanthrene;9-[4-(4-phenanthren-9-ylphenyl)phenyl]phenanthrene
CID 158279425
1-(3-methylbutyl)-3-phenylbenzene
CID 21063782
2-methyl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene
CID 59793052
4-(3-methylphenyl)-6-(4-phenanthren-9-ylphenyl)-2-phenylpyrimidine
CID 129128235

Frequently Asked Questions

What is the IUPAC name of hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene?
The IUPAC name of hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene (CID 142343119) is hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene.
What is the SMILES notation for hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene?
The canonical SMILES for hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene is Cc1ccccc1.NN.c1ccc(-c2cccc(CCc3cccc4c3-c3cc(-c5cc6ccccc6c6ccccc56)cc(-c5cc6ccccc6c6ccccc56)c3C4)c2)cc1.
What is the InChIKey of hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene?
The InChIKey is ULIDOKRRQNGEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H38.C7H8.H4N2/c1-2-15-37(16-3-1)39-20-12-14-36(30-39)28-29-38-19-13-21-42-33-53-52(51-32-41-18-5-7-23-45(41)47-25-9-11-27-49(47)51)34-43(35-54(53)55(38)42)50-31-40-17-4-6-22-44(40)46-24-8-10-26-48(46)50;1-7-5-3-2-4-6-7;1-2/h1-27,30-32,34-35H,28-29,33H2;2-6H,1H3;1-2H2.
What are the key properties of hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene?
hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene has a molecular weight of 823.10 g/mol, XLogP of 15.47, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazine;9-[1-phenanthren-9-yl-5-[2-(3-phenylphenyl)ethyl]-9H-fluoren-3-yl]phenanthrene;toluene is sourced from PubChem (CID 142343119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).