ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene

C24H32 — CID 142106350

IUPACethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene
SMILESC=c1c2c(c3ccccc3/c1=C/C=C\CC)C=CCC2.CC.CC
InChIInChI=1S/C20H20.2C2H6/c1-3-4-5-10-16-15(2)17-11-6-7-12-19(17)20-14-9-8-13-18(16)20;2*1-2/h4-5,7-10,12-14H,2-3,6,11H2,1H3;2*1-2H3/b5-4-,16-10+;;
InChIKeySCGMAVPYFYUYCV-HNEZGDTOSA-N
MW320.52 g/mol
LogP6.01
Rot. Bonds2

About ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene

ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene (PubChem CID 142106350) has the molecular formula C24H32 and a molecular weight of 320.52 g/mol. Its IUPAC name is ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene.

Molecular Properties

Compound Nameethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene
PubChem CID142106350
Molecular FormulaC24H32
Molecular Weight320.52 g/mol
Exact Mass320.25
IUPAC Nameethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene
SMILESC=c1c2c(c3ccccc3/c1=C/C=C\CC)C=CCC2.CC.CC
InChIInChI=1S/C20H20.2C2H6/c1-3-4-5-10-16-15(2)17-11-6-7-12-19(17)20-14-9-8-13-18(16)20;2*1-2/h4-5,7-10,12-14H,2-3,6,11H2,1H3;2*1-2H3/b5-4-,16-10+;;
InChIKeySCGMAVPYFYUYCV-HNEZGDTOSA-N
XLogP6.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.52
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9,10-dimethyl-1,2-dihydroanthracene
CID 71409601
ethane;5-ethenyl-6-methyl-7,8-dihydrobenzo[f]quinoline;propane
CID 145327739
9,10-dimethyl-3,4-dihydrophenanthrene
CID 142416253
6-methyl-1,2-dihydrotriphenylene
CID 123255484
9,10-dichloro-1,2-dihydroanthracene
CID 154158053
10-methyl-9-(4-methylphenyl)-1,2-dihydroanthracene
CID 143123986
9,10-di(propan-2-yl)-3,4-dihydrophenanthrene
CID 155644326
7,8-dihydro-5H-phenanthridin-6-one
CID 118650763
6-bromo-1,2-dihydrotriphenylene
CID 144751099
(10E)-9-methylidene-10-prop-2-enylidenephenanthrene
CID 145283631
dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane
CID 166895339
6-methyl-3,4-dihydrophenanthridine
CID 142408589

Frequently Asked Questions

What is the IUPAC name of ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene?
The IUPAC name of ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene (CID 142106350) is ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene.
What is the SMILES notation for ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene?
The canonical SMILES for ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene is C=c1c2c(c3ccccc3/c1=C/C=C\CC)C=CCC2.CC.CC.
What is the InChIKey of ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene?
The InChIKey is SCGMAVPYFYUYCV-HNEZGDTOSA-N. The full InChI is InChI=1S/C20H20.2C2H6/c1-3-4-5-10-16-15(2)17-11-6-7-12-19(17)20-14-9-8-13-18(16)20;2*1-2/h4-5,7-10,12-14H,2-3,6,11H2,1H3;2*1-2H3/b5-4-,16-10+;;.
What are the key properties of ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene?
ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene has a molecular weight of 320.52 g/mol, XLogP of 6.01, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(9E)-10-methylidene-9-[(Z)-pent-2-enylidene]-1,2-dihydrophenanthrene is sourced from PubChem (CID 142106350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).