2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)

C131H204 — CID 158656966

IUPAC2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.CC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.c1ccc2cc(C(c3ccc4ccccc4c3)c3ccc4ccccc4c3)ccc2c1.c1ccc2ccccc2c1
InChIInChI=1S/C31H22.2C22H18.C10H8.23C2H6/c1-4-10-25-19-28(16-13-22(25)7-1)31(29-17-14-23-8-2-5-11-26(23)20-29)30-18-15-24-9-3-6-12-27(24)21-30;2*1-16(19-12-10-17-6-2-4-8-21(17)14-19)20-13-11-18-7-3-5-9-22(18)15-20;1-2-6-10-8-4-3-7-9(10)5-1;23*1-2/h1-21,31H;2*2-16H,1H3;1-8H;23*1-2H3
InChIKeyICGKZRAYIWOJBY-UHFFFAOYSA-N
MW1779.07 g/mol
LogP47.06
Rot. Bonds7

About 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)

2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene) (PubChem CID 158656966) has the molecular formula C131H204 and a molecular weight of 1779.07 g/mol. Its IUPAC name is 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene).

Molecular Properties

Compound Name2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)
PubChem CID158656966
Molecular FormulaC131H204
Molecular Weight1779.07 g/mol
Exact Mass1777.60
IUPAC Name2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.CC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.c1ccc2cc(C(c3ccc4ccccc4c3)c3ccc4ccccc4c3)ccc2c1.c1ccc2ccccc2c1
InChIInChI=1S/C31H22.2C22H18.C10H8.23C2H6/c1-4-10-25-19-28(16-13-22(25)7-1)31(29-17-14-23-8-2-5-11-26(23)20-29)30-18-15-24-9-3-6-12-27(24)21-30;2*1-16(19-12-10-17-6-2-4-8-21(17)14-19)20-13-11-18-7-3-5-9-22(18)15-20;1-2-6-10-8-4-3-7-9(10)5-1;23*1-2/h1-21,31H;2*2-16H,1H3;1-8H;23*1-2H3
InChIKeyICGKZRAYIWOJBY-UHFFFAOYSA-N
XLogP47.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms131
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001779.07
LogP ≤ 547.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

ethane;2-propan-2-ylnaphthalene
CID 142226111
[(1S)-1-naphthalen-2-ylethyl]azanium chloride
CID 155931519
2-propan-2-ylpentacene
CID 153380535
cumene;ethane;methane;2-propan-2-ylnaphthalene
CID 158431045
2,6-di(propan-2-yl)naphthalene;ethane
CID 142320223
1-naphthalen-2-ylethanethiol
CID 11672816
1-naphthalen-2-ylethanamine
CID 3857145
2-[bis(3,4-dimethoxyphenyl)methyl]naphthalene
CID 56601628
3-naphthalen-2-ylbutan-2-amine
CID 66436107
methyl-[(1R)-1-naphthalen-2-ylethyl]azanide
CID 59298029
trimethyl-[(1S)-1-naphthalen-2-ylethyl]azanium
CID 71541621
2-[naphthalen-2-yl(1H-pyrrol-2-yl)methyl]-1H-pyrrole
CID 102416621

Frequently Asked Questions

What is the IUPAC name of 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)?
The IUPAC name of 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene) (CID 158656966) is 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene).
What is the SMILES notation for 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)?
The canonical SMILES for 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.CC(c1ccc2ccccc2c1)c1ccc2ccccc2c1.c1ccc2cc(C(c3ccc4ccccc4c3)c3ccc4ccccc4c3)ccc2c1.c1ccc2ccccc2c1.
What is the InChIKey of 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)?
The InChIKey is ICGKZRAYIWOJBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H22.2C22H18.C10H8.23C2H6/c1-4-10-25-19-28(16-13-22(25)7-1)31(29-17-14-23-8-2-5-11-26(23)20-29)30-18-15-24-9-3-6-12-27(24)21-30;2*1-16(19-12-10-17-6-2-4-8-21(17)14-19)20-13-11-18-7-3-5-9-22(18)15-20;1-2-6-10-8-4-3-7-9(10)5-1;23*1-2/h1-21,31H;2*2-16H,1H3;1-8H;23*1-2H3.
What are the key properties of 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene)?
2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene) has a molecular weight of 1779.07 g/mol, XLogP of 47.06, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dinaphthalen-2-ylmethyl)naphthalene;ethane;naphthalene;bis(2-(1-naphthalen-2-ylethyl)naphthalene) is sourced from PubChem (CID 158656966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).