1-benzhydrylidene-2H-naphthalene

C23H18 — CID 172757521

IUPAC1-benzhydrylidene-2H-naphthalene
SMILESC1=Cc2ccccc2C(=C(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C23H18/c1-3-11-19(12-4-1)23(20-13-5-2-6-14-20)22-17-9-15-18-10-7-8-16-21(18)22/h1-16H,17H2
InChIKeyLFRIBLCLYYRACN-UHFFFAOYSA-N
MW294.40 g/mol
LogP6.06
Rot. Bonds2

About 1-benzhydrylidene-2H-naphthalene

1-benzhydrylidene-2H-naphthalene (PubChem CID 172757521) has the molecular formula C23H18 and a molecular weight of 294.40 g/mol. Its IUPAC name is 1-benzhydrylidene-2H-naphthalene.

Molecular Properties

Compound Name1-benzhydrylidene-2H-naphthalene
PubChem CID172757521
Molecular FormulaC23H18
Molecular Weight294.40 g/mol
Exact Mass294.14
IUPAC Name1-benzhydrylidene-2H-naphthalene
SMILESC1=Cc2ccccc2C(=C(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C23H18/c1-3-11-19(12-4-1)23(20-13-5-2-6-14-20)22-17-9-15-18-10-7-8-16-21(18)22/h1-16H,17H2
InChIKeyLFRIBLCLYYRACN-UHFFFAOYSA-N
XLogP6.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.40
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-[2H-naphthalen-1-ylidene(phenyl)methyl]naphthalen-1-ol
CID 175718818
2-(2H-naphthalen-1-ylidene)hexanedioic acid
CID 70048457
2H-naphthalen-1-one;hydrobromide
CID 21419388
hydrogen peroxide;1H-indene;hydrobromide
CID 158452751
2H-naphthalen-1-imine
CID 22066265
4-benzhydrylidene-5-phenyl-2,3-dihydropyrrole
CID 71403996
1H-indene;phenol
CID 22398273
1-(methoxymethylidene)-2H-naphthalene
CID 66891082
1H-indene;1-methylideneindene
CID 174321289
1,4-diphenylbenzene;1H-indene
CID 156634731
1H-indene;methane
CID 22114429
copper;1H-indene
CID 175216856

Frequently Asked Questions

What is the IUPAC name of 1-benzhydrylidene-2H-naphthalene?
The IUPAC name of 1-benzhydrylidene-2H-naphthalene (CID 172757521) is 1-benzhydrylidene-2H-naphthalene.
What is the SMILES notation for 1-benzhydrylidene-2H-naphthalene?
The canonical SMILES for 1-benzhydrylidene-2H-naphthalene is C1=Cc2ccccc2C(=C(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of 1-benzhydrylidene-2H-naphthalene?
The InChIKey is LFRIBLCLYYRACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18/c1-3-11-19(12-4-1)23(20-13-5-2-6-14-20)22-17-9-15-18-10-7-8-16-21(18)22/h1-16H,17H2.
What are the key properties of 1-benzhydrylidene-2H-naphthalene?
1-benzhydrylidene-2H-naphthalene has a molecular weight of 294.40 g/mol, XLogP of 6.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydrylidene-2H-naphthalene is sourced from PubChem (CID 172757521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).