carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)

C32H52O2Rf4-4 — CID 161112043

IUPACcarbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)
SMILESCC1(C)C(C)(C)C(C)(C)C(c2ccc(O)cc2)(c2ccc(O)cc2)C(C)(C)C1(C)C.[CH3-].[CH3-].[CH3-].[CH3-].[Rf].[Rf].[Rf].[Rf]
InChIInChI=1S/C28H40O2.4CH3.4Rf/c1-23(2)24(3,4)26(7,8)28(27(9,10)25(23,5)6,19-11-15-21(29)16-12-19)20-13-17-22(30)18-14-20;;;;;;;;/h11-18,29-30H,1-10H3;4*1H3;;;;/q;4*-1;;;;
InChIKeyATDDCQQVFVVPQQ-UHFFFAOYSA-N
MW1536.77 g/mol
LogP9.33
Rot. Bonds2

About carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)

carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium) (PubChem CID 161112043) has the molecular formula C32H52O2Rf4-4 and a molecular weight of 1536.77 g/mol. Its IUPAC name is carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium).

Molecular Properties

Compound Namecarbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)
PubChem CID161112043
Molecular FormulaC32H52O2Rf4-4
Molecular Weight1536.77 g/mol
Exact Mass1536.89
IUPAC Namecarbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)
SMILESCC1(C)C(C)(C)C(C)(C)C(c2ccc(O)cc2)(c2ccc(O)cc2)C(C)(C)C1(C)C.[CH3-].[CH3-].[CH3-].[CH3-].[Rf].[Rf].[Rf].[Rf]
InChIInChI=1S/C28H40O2.4CH3.4Rf/c1-23(2)24(3,4)26(7,8)28(27(9,10)25(23,5)6,19-11-15-21(29)16-12-19)20-13-17-22(30)18-14-20;;;;;;;;/h11-18,29-30H,1-10H3;4*1H3;;;;/q;4*-1;;;;
InChIKeyATDDCQQVFVVPQQ-UHFFFAOYSA-N
XLogP9.33
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001536.77
LogP ≤ 59.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)?
The IUPAC name of carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium) (CID 161112043) is carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium).
What is the SMILES notation for carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)?
The canonical SMILES for carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium) is CC1(C)C(C)(C)C(C)(C)C(c2ccc(O)cc2)(c2ccc(O)cc2)C(C)(C)C1(C)C.[CH3-].[CH3-].[CH3-].[CH3-].[Rf].[Rf].[Rf].[Rf].
What is the InChIKey of carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)?
The InChIKey is ATDDCQQVFVVPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H40O2.4CH3.4Rf/c1-23(2)24(3,4)26(7,8)28(27(9,10)25(23,5)6,19-11-15-21(29)16-12-19)20-13-17-22(30)18-14-20;;;;;;;;/h11-18,29-30H,1-10H3;4*1H3;;;;/q;4*-1;;;;.
What are the key properties of carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium)?
carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium) has a molecular weight of 1536.77 g/mol, XLogP of 9.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;4-[1-(4-hydroxyphenyl)-2,2,3,3,4,4,5,5,6,6-decamethylcyclohexyl]phenol;tetrakis(rutherfordium) is sourced from PubChem (CID 161112043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).