ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene

C26H24 — CID 143793732

IUPACethane;9-naphthalen-1-yl-4a,10-dihydroanthracene
SMILESC1=CC2=C(c3cccc4ccccc34)c3ccccc3CC2C=C1.CC
InChIInChI=1S/C24H18.C2H6/c1-4-12-20-17(8-1)11-7-15-23(20)24-21-13-5-2-9-18(21)16-19-10-3-6-14-22(19)24;1-2/h1-15,18H,16H2;1-2H3
InChIKeyNMQPAOUNXFLCIC-UHFFFAOYSA-N
MW336.48 g/mol
LogP6.97
Rot. Bonds1

About ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene

ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene (PubChem CID 143793732) has the molecular formula C26H24 and a molecular weight of 336.48 g/mol. Its IUPAC name is ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene.

Molecular Properties

Compound Nameethane;9-naphthalen-1-yl-4a,10-dihydroanthracene
PubChem CID143793732
Molecular FormulaC26H24
Molecular Weight336.48 g/mol
Exact Mass336.19
IUPAC Nameethane;9-naphthalen-1-yl-4a,10-dihydroanthracene
SMILESC1=CC2=C(c3cccc4ccccc34)c3ccccc3CC2C=C1.CC
InChIInChI=1S/C24H18.C2H6/c1-4-12-20-17(8-1)11-7-15-23(20)24-21-13-5-2-9-18(21)16-19-10-3-6-14-22(19)24;1-2/h1-15,18H,16H2;1-2H3
InChIKeyNMQPAOUNXFLCIC-UHFFFAOYSA-N
XLogP6.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.48
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-(9,10-dinaphthalen-1-ylanthracen-2-yl)-7,7a-dihydrobenzo[a]anthracene
CID 163827100
5-naphthalen-1-yl-9H-benzo[7]annulene
CID 142998872
9-naphthalen-1-yl-10-(3-tricyclo[7.4.1.02,7]tetradeca-2(7),3,5,9(14),10,12-hexaenyl)anthracene
CID 145232758
9-[4-(2,3,4,4a-tetrahydronaphthalen-1-yl)phenyl]-2-methyl-10-(4-naphthalen-1-ylphenyl)anthracene
CID 123530986
2,3-dinaphthalen-1-ylcyclohexa-2,5-diene-1,4-dione
CID 22501380
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
9-(5,10-dihydrobenzo[10]annulen-11-yl)-10-naphthalen-1-ylanthracene
CID 123889750
(4aE,7Z,9Z,12E)-6-methyl-5,12-bis(4-naphthalen-1-ylphenyl)-6,11-dihydrobenzo[10]annulene
CID 140818670

Frequently Asked Questions

What is the IUPAC name of ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene?
The IUPAC name of ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene (CID 143793732) is ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene.
What is the SMILES notation for ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene?
The canonical SMILES for ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene is C1=CC2=C(c3cccc4ccccc34)c3ccccc3CC2C=C1.CC.
What is the InChIKey of ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene?
The InChIKey is NMQPAOUNXFLCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18.C2H6/c1-4-12-20-17(8-1)11-7-15-23(20)24-21-13-5-2-9-18(21)16-19-10-3-6-14-22(19)24;1-2/h1-15,18H,16H2;1-2H3.
What are the key properties of ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene?
ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene has a molecular weight of 336.48 g/mol, XLogP of 6.97, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;9-naphthalen-1-yl-4a,10-dihydroanthracene is sourced from PubChem (CID 143793732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).