osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)

C34H60N2OsP2 — CID 147264576

IUPACosmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)
SMILESCC(C)[PH+](C(C)C)C(C)C.CC(C)[PH+](C(C)C)C(C)C.Cc1cc2c(cc1C)N(c1[c-]cccc1)[CH-]N2C.[Os]
InChIInChI=1S/C16H16N2.2C9H21P.Os/c1-12-9-15-16(10-13(12)2)18(11-17(15)3)14-7-5-4-6-8-14;2*1-7(2)10(8(3)4)9(5)6;/h4-7,9-11H,1-3H3;2*7-9H,1-6H3;/q-2;;;/p+2
InChIKeyDXQHZPZIKYPLPR-UHFFFAOYSA-P
MW749.05 g/mol
LogP10.66
Rot. Bonds7

About osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)

osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium) (PubChem CID 147264576) has the molecular formula C34H60N2OsP2 and a molecular weight of 749.05 g/mol. Its IUPAC name is osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium).

Molecular Properties

Compound Nameosmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)
PubChem CID147264576
Molecular FormulaC34H60N2OsP2
Molecular Weight749.05 g/mol
Exact Mass750.38
IUPAC Nameosmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)
SMILESCC(C)[PH+](C(C)C)C(C)C.CC(C)[PH+](C(C)C)C(C)C.Cc1cc2c(cc1C)N(c1[c-]cccc1)[CH-]N2C.[Os]
InChIInChI=1S/C16H16N2.2C9H21P.Os/c1-12-9-15-16(10-13(12)2)18(11-17(15)3)14-7-5-4-6-8-14;2*1-7(2)10(8(3)4)9(5)6;/h4-7,9-11H,1-3H3;2*7-9H,1-6H3;/q-2;;;/p+2
InChIKeyDXQHZPZIKYPLPR-UHFFFAOYSA-P
XLogP10.66
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500749.05
LogP ≤ 510.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

lawrencium;1-methyl-3-phenyl-2H-benzimidazol-2-ide
CID 170209546
carbanide;1-methyl-3-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]-2H-benzimidazol-2-ide;osmium monohydride;tri(propan-2-yl)phosphanium
CID 161458362
bis(1,2-dihydroimidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum
CID 172514234
bis(1,4-dimethyl-2H-imidazol-2-ide);bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);platinum
CID 172514289
1,4-dimethyl-3-phenyl-2H-imidazol-2-ide;iridium
CID 140837724
1,5-bis(2-methylphenyl)-3-phenyl-2H-benzimidazol-2-ide;iridium
CID 140794449
platinum(4+);1,5,6-trimethyl-3-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-2H-benzimidazol-2-ide;cyanide
CID 164730512
4-(2,6-dimethylphenyl)-3-(2-methylphenyl)-5-phenyl-1,2,4-triazole;iridium(3+);1-methyl-3-phenyl-2H-benzimidazol-2-ide
CID 140736391
1,4,4,5,5,6,6-heptamethyl-3-phenyl-2H-cyclopenta[d]imidazol-2-ide;iridium
CID 140677085
iridium;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide
CID 58556265
iridium;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-phenyl-3-[4-(3-phenyl-2H-benzimidazol-2-id-1-yl)butyl]-2H-benzimidazol-2-ide
CID 155625565
CID 140637817
CID 140637817

Frequently Asked Questions

What is the IUPAC name of osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)?
The IUPAC name of osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium) (CID 147264576) is osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium).
What is the SMILES notation for osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)?
The canonical SMILES for osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium) is CC(C)[PH+](C(C)C)C(C)C.CC(C)[PH+](C(C)C)C(C)C.Cc1cc2c(cc1C)N(c1[c-]cccc1)[CH-]N2C.[Os].
What is the InChIKey of osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)?
The InChIKey is DXQHZPZIKYPLPR-UHFFFAOYSA-P. The full InChI is InChI=1S/C16H16N2.2C9H21P.Os/c1-12-9-15-16(10-13(12)2)18(11-17(15)3)14-7-5-4-6-8-14;2*1-7(2)10(8(3)4)9(5)6;/h4-7,9-11H,1-3H3;2*7-9H,1-6H3;/q-2;;;/p+2.
What are the key properties of osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium)?
osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium) has a molecular weight of 749.05 g/mol, XLogP of 10.66, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for osmium;1,5,6-trimethyl-3-phenyl-2H-benzimidazol-2-ide;bis(tri(propan-2-yl)phosphanium) is sourced from PubChem (CID 147264576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).