6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene

C23H27Cl — CID 54469191

IUPAC6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
SMILESCC(=Cc1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc(Cl)cc1
InChIInChI=1S/C23H27Cl/c1-16(18-7-9-19(24)10-8-18)14-17-6-11-20-21(15-17)23(4,5)13-12-22(20,2)3/h6-11,14-15H,12-13H2,1-5H3
InChIKeyXHCDWRPNRUHZCA-UHFFFAOYSA-N
MW338.92 g/mol
LogP7.25
Rot. Bonds2

About 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene

6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene (PubChem CID 54469191) has the molecular formula C23H27Cl and a molecular weight of 338.92 g/mol. Its IUPAC name is 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene.

Molecular Properties

Compound Name6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
PubChem CID54469191
Molecular FormulaC23H27Cl
Molecular Weight338.92 g/mol
Exact Mass338.18
IUPAC Name6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
SMILESCC(=Cc1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc(Cl)cc1
InChIInChI=1S/C23H27Cl/c1-16(18-7-9-19(24)10-8-18)14-17-6-11-20-21(15-17)23(4,5)13-12-22(20,2)3/h6-11,14-15H,12-13H2,1-5H3
InChIKeyXHCDWRPNRUHZCA-UHFFFAOYSA-N
XLogP7.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.92
LogP ≤ 57.25
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

N-methyl-4-[(E)-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-en-2-yl]aniline
CID 20672226
1,1,4,4-tetramethyl-6-[2-(4-prop-2-enylphenyl)prop-1-enyl]-2,3-dihydronaphthalene
CID 54446394
4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzenethiol
CID 54087498
[5-[1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-en-2-yl]-2-pyridinyl]methanol
CID 72608188
2,2,2-trifluoro-N-[4-[(Z)-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-en-2-yl]phenyl]acetamide
CID 59963145
6-[(E)-1-(3,5-dimethylphenyl)prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 14425598
1,1,4,4-tetramethyl-6-[(E)-1-(4-phenylphenyl)prop-1-en-2-yl]-2,3-dihydronaphthalene
CID 14425582
1,1,4,4-tetramethyl-6-[(Z)-1-(4-phenylphenyl)prop-1-en-2-yl]-2,3-dihydronaphthalene
CID 18990095
[4-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]phenyl]phosphonic acid
CID 14371698
4-[(Z)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzenesulfonic acid
CID 6439761
5-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]-1,3-benzodioxol-2-one
CID 70411697
6-[(E)-1-(4-ethylsulfonylphenyl)prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 6435463

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene?
The IUPAC name of 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene (CID 54469191) is 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene.
What is the SMILES notation for 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene?
The canonical SMILES for 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene is CC(=Cc1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc(Cl)cc1.
What is the InChIKey of 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene?
The InChIKey is XHCDWRPNRUHZCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27Cl/c1-16(18-7-9-19(24)10-8-18)14-17-6-11-20-21(15-17)23(4,5)13-12-22(20,2)3/h6-11,14-15H,12-13H2,1-5H3.
What are the key properties of 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene?
6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene has a molecular weight of 338.92 g/mol, XLogP of 7.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-chlorophenyl)prop-1-enyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene is sourced from PubChem (CID 54469191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).