naphthalene;bis(1,3,5-trimethylbenzene)

C28H32 — CID 158615214

IUPACnaphthalene;bis(1,3,5-trimethylbenzene)
SMILESCc1cc(C)cc(C)c1.Cc1cc(C)cc(C)c1.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.2C9H12/c1-2-6-10-8-4-3-7-9(10)5-1;2*1-7-4-8(2)6-9(3)5-7/h1-8H;2*4-6H,1-3H3
InChIKeyHXHONUVFBKTNGE-UHFFFAOYSA-N
MW368.56 g/mol
LogP8.06
Rot. Bonds

About naphthalene;bis(1,3,5-trimethylbenzene)

naphthalene;bis(1,3,5-trimethylbenzene) (PubChem CID 158615214) has the molecular formula C28H32 and a molecular weight of 368.56 g/mol. Its IUPAC name is naphthalene;bis(1,3,5-trimethylbenzene).

Molecular Properties

Compound Namenaphthalene;bis(1,3,5-trimethylbenzene)
PubChem CID158615214
Molecular FormulaC28H32
Molecular Weight368.56 g/mol
Exact Mass368.25
IUPAC Namenaphthalene;bis(1,3,5-trimethylbenzene)
SMILESCc1cc(C)cc(C)c1.Cc1cc(C)cc(C)c1.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.2C9H12/c1-2-6-10-8-4-3-7-9(10)5-1;2*1-7-4-8(2)6-9(3)5-7/h1-8H;2*4-6H,1-3H3
InChIKeyHXHONUVFBKTNGE-UHFFFAOYSA-N
XLogP8.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.56
LogP ≤ 58.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of naphthalene;bis(1,3,5-trimethylbenzene)?
The IUPAC name of naphthalene;bis(1,3,5-trimethylbenzene) (CID 158615214) is naphthalene;bis(1,3,5-trimethylbenzene).
What is the SMILES notation for naphthalene;bis(1,3,5-trimethylbenzene)?
The canonical SMILES for naphthalene;bis(1,3,5-trimethylbenzene) is Cc1cc(C)cc(C)c1.Cc1cc(C)cc(C)c1.c1ccc2ccccc2c1.
What is the InChIKey of naphthalene;bis(1,3,5-trimethylbenzene)?
The InChIKey is HXHONUVFBKTNGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8.2C9H12/c1-2-6-10-8-4-3-7-9(10)5-1;2*1-7-4-8(2)6-9(3)5-7/h1-8H;2*4-6H,1-3H3.
What are the key properties of naphthalene;bis(1,3,5-trimethylbenzene)?
naphthalene;bis(1,3,5-trimethylbenzene) has a molecular weight of 368.56 g/mol, XLogP of 8.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalene;bis(1,3,5-trimethylbenzene) is sourced from PubChem (CID 158615214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).