9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene

C30H26 — CID 123681996

IUPAC9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene
SMILESC1=C(c2c3ccccc3c(C3=CCCc4ccccc43)c3ccccc23)CCCC1
InChIInChI=1S/C30H26/c1-2-12-22(13-3-1)29-25-16-6-8-18-27(25)30(28-19-9-7-17-26(28)29)24-20-10-14-21-11-4-5-15-23(21)24/h4-9,11-12,15-20H,1-3,10,13-14H2
InChIKeyHDBPFWUVKXREMX-UHFFFAOYSA-N
MW386.54 g/mol
LogP8.33
Rot. Bonds2

About 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene

9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene (PubChem CID 123681996) has the molecular formula C30H26 and a molecular weight of 386.54 g/mol. Its IUPAC name is 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene.

Molecular Properties

Compound Name9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene
PubChem CID123681996
Molecular FormulaC30H26
Molecular Weight386.54 g/mol
Exact Mass386.20
IUPAC Name9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene
SMILESC1=C(c2c3ccccc3c(C3=CCCc4ccccc43)c3ccccc23)CCCC1
InChIInChI=1S/C30H26/c1-2-12-22(13-3-1)29-25-16-6-8-18-27(25)30(28-19-9-7-17-26(28)29)24-20-10-14-21-11-4-5-15-23(21)24/h4-9,11-12,15-20H,1-3,10,13-14H2
InChIKeyHDBPFWUVKXREMX-UHFFFAOYSA-N
XLogP8.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.54
LogP ≤ 58.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

4-[10-(3,4-dihydronaphthalen-1-yl)anthracen-9-yl]quinoline
CID 88547922
9-(cycloocten-1-yl)-10-naphthalen-2-ylanthracene
CID 123875483
9-(3,4-dihydronaphthalen-1-yl)-10-naphthalen-1-ylanthracene;9-(3,4-dihydronaphthalen-1-yl)-10-phenanthren-9-ylanthracene;9-(3,4-dihydronaphthalen-1-yl)-10-(4-phenylphenyl)anthracene
CID 158707285
5-phenyl-8,9-dihydro-7H-benzo[7]annulene
CID 10857019
4-(3,4-dihydronaphthalen-1-yl)-3,5-dimethyl-1,2-oxazole
CID 135045577
11-[3-[10-(3,4-dihydronaphthalen-1-yl)anthracen-9-yl]phenyl]-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaene
CID 163923293
9-[4-(3,4-dihydronaphthalen-1-yl)phenyl]-10-[4-(3,4-dihydronaphthalen-2-yl)phenyl]-2-(3H-inden-1-yl)anthracene
CID 140575759
3-(cyclohexen-1-yl)-1,2-dimethylindole
CID 15619846
2-(cyclohexen-1-yl)aniline;rhodium
CID 166447509
1-(2-phenylphenyl)cycloheptene
CID 71332036
(1E)-1-(2-chlorophenyl)cyclodecene
CID 165358965
4-(cyclohexen-1-yl)-3-trimethylsilylisochromen-1-one
CID 10614043

Frequently Asked Questions

What is the IUPAC name of 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene?
The IUPAC name of 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene (CID 123681996) is 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene.
What is the SMILES notation for 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene?
The canonical SMILES for 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene is C1=C(c2c3ccccc3c(C3=CCCc4ccccc43)c3ccccc23)CCCC1.
What is the InChIKey of 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene?
The InChIKey is HDBPFWUVKXREMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26/c1-2-12-22(13-3-1)29-25-16-6-8-18-27(25)30(28-19-9-7-17-26(28)29)24-20-10-14-21-11-4-5-15-23(21)24/h4-9,11-12,15-20H,1-3,10,13-14H2.
What are the key properties of 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene?
9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene has a molecular weight of 386.54 g/mol, XLogP of 8.33, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(cyclohexen-1-yl)-10-(3,4-dihydronaphthalen-1-yl)anthracene is sourced from PubChem (CID 123681996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).