carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene

C60H120NORe4Rf2RhS-7 — CID 157438143

IUPACcarbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene
SMILESC.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccccc1.Cc1ccccn1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Re].[Re].[Re].[Re].[Rf].[Rf].[Rh].c1ccc2ccccc2c1.c1ccoc1.c1ccsc1
InChIInChI=1S/C10H8.C7H8.C6H7N.C4H4O.C4H4S.10C2H6.2CH4.7CH3.4Re.2Rf.Rh/c1-2-6-10-8-4-3-7-9(10)5-1;1-7-5-3-2-4-6-7;1-6-4-2-3-5-7-6;2*1-2-4-5-3-1;10*1-2;;;;;;;;;;;;;;;;/h1-8H;2-6H,1H3;2-5H,1H3;2*1-4H;10*1-2H3;2*1H4;7*1H3;;;;;;;/q;;;;;;;;;;;;;;;;;7*-1;;;;;;;
InChIKeyDLAGFIHSOTUNRW-UHFFFAOYSA-N
MW2285.43 g/mol
LogP23.93
Rot. Bonds

About carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene

carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene (PubChem CID 157438143) has the molecular formula C60H120NORe4Rf2RhS-7 and a molecular weight of 2285.43 g/mol. Its IUPAC name is carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene.

Molecular Properties

Compound Namecarbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene
PubChem CID157438143
Molecular FormulaC60H120NORe4Rf2RhS-7
Molecular Weight2285.43 g/mol
Exact Mass2287.88
IUPAC Namecarbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene
SMILESC.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccccc1.Cc1ccccn1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Re].[Re].[Re].[Re].[Rf].[Rf].[Rh].c1ccc2ccccc2c1.c1ccoc1.c1ccsc1
InChIInChI=1S/C10H8.C7H8.C6H7N.C4H4O.C4H4S.10C2H6.2CH4.7CH3.4Re.2Rf.Rh/c1-2-6-10-8-4-3-7-9(10)5-1;1-7-5-3-2-4-6-7;1-6-4-2-3-5-7-6;2*1-2-4-5-3-1;10*1-2;;;;;;;;;;;;;;;;/h1-8H;2-6H,1H3;2-5H,1H3;2*1-4H;10*1-2H3;2*1H4;7*1H3;;;;;;;/q;;;;;;;;;;;;;;;;;7*-1;;;;;;;
InChIKeyDLAGFIHSOTUNRW-UHFFFAOYSA-N
XLogP23.93
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms70
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002285.43
LogP ≤ 523.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene?
The IUPAC name of carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene (CID 157438143) is carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene.
What is the SMILES notation for carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene?
The canonical SMILES for carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene is C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccccc1.Cc1ccccn1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Re].[Re].[Re].[Re].[Rf].[Rf].[Rh].c1ccc2ccccc2c1.c1ccoc1.c1ccsc1.
What is the InChIKey of carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene?
The InChIKey is DLAGFIHSOTUNRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8.C7H8.C6H7N.C4H4O.C4H4S.10C2H6.2CH4.7CH3.4Re.2Rf.Rh/c1-2-6-10-8-4-3-7-9(10)5-1;1-7-5-3-2-4-6-7;1-6-4-2-3-5-7-6;2*1-2-4-5-3-1;10*1-2;;;;;;;;;;;;;;;;/h1-8H;2-6H,1H3;2-5H,1H3;2*1-4H;10*1-2H3;2*1H4;7*1H3;;;;;;;/q;;;;;;;;;;;;;;;;;7*-1;;;;;;;.
What are the key properties of carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene?
carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene has a molecular weight of 2285.43 g/mol, XLogP of 23.93, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;furan;methane;2-methylpyridine;naphthalene;rhenium;rhodium;bis(rutherfordium);thiophene;toluene is sourced from PubChem (CID 157438143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).