(9E)-9-ethylidene-10-methylidenephenanthrene

C17H14 — CID 142424633

IUPAC(9E)-9-ethylidene-10-methylidenephenanthrene
SMILESC=c1/c(=C\C)c2ccccc2c2ccccc12
InChIInChI=1S/C17H14/c1-3-13-12(2)14-8-4-5-10-16(14)17-11-7-6-9-15(13)17/h3-11H,2H2,1H3/b13-3+
InChIKeyHLQCYSGTCKLLKZ-QLKAYGNNSA-N
MW218.30 g/mol
LogP3.20
Rot. Bonds

About (9E)-9-ethylidene-10-methylidenephenanthrene

(9E)-9-ethylidene-10-methylidenephenanthrene (PubChem CID 142424633) has the molecular formula C17H14 and a molecular weight of 218.30 g/mol. Its IUPAC name is (9E)-9-ethylidene-10-methylidenephenanthrene.

Molecular Properties

Compound Name(9E)-9-ethylidene-10-methylidenephenanthrene
PubChem CID142424633
Molecular FormulaC17H14
Molecular Weight218.30 g/mol
Exact Mass218.11
IUPAC Name(9E)-9-ethylidene-10-methylidenephenanthrene
SMILESC=c1/c(=C\C)c2ccccc2c2ccccc12
InChIInChI=1S/C17H14/c1-3-13-12(2)14-8-4-5-10-16(14)17-11-7-6-9-15(13)17/h3-11H,2H2,1H3/b13-3+
InChIKeyHLQCYSGTCKLLKZ-QLKAYGNNSA-N
XLogP3.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

(10E)-9-methylidene-10-prop-2-enylidenephenanthrene
CID 145283631
9-(6-methyl-2,3-dimethylidenehepta-4,6-dienylidene)-10-methylidenephenanthrene
CID 123440428
hexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1(14),2,4,6,8,10,12,15,17,19,21,23,25-tridecaene;methanethiol
CID 159766512
(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene
CID 145120171
2-ethylidene-3-methylidene-1H-indole
CID 131846475
ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene
CID 145120170
(1E)-1-ethylidene-3-methyl-2-methylidene-4-phenyl-6-propan-2-ylnaphthalene
CID 145276200
9,10-diphenylanthracene;ethane;prop-1-ene
CID 90840257
3-(3-ethylidene-2-methylideneindol-1-yl)-N,N-dimethylpropan-1-amine
CID 91345374
(2E,3Z)-2,3-di(ethylidene)-1-benzofuran;ethane
CID 142109004
2-ethyl-9,10-dimethylideneanthracene
CID 142246344
(1Z)-1-ethylidene-2-methyl-3-methylideneisoindole
CID 137397306

Frequently Asked Questions

What is the IUPAC name of (9E)-9-ethylidene-10-methylidenephenanthrene?
The IUPAC name of (9E)-9-ethylidene-10-methylidenephenanthrene (CID 142424633) is (9E)-9-ethylidene-10-methylidenephenanthrene.
What is the SMILES notation for (9E)-9-ethylidene-10-methylidenephenanthrene?
The canonical SMILES for (9E)-9-ethylidene-10-methylidenephenanthrene is C=c1/c(=C\C)c2ccccc2c2ccccc12.
What is the InChIKey of (9E)-9-ethylidene-10-methylidenephenanthrene?
The InChIKey is HLQCYSGTCKLLKZ-QLKAYGNNSA-N. The full InChI is InChI=1S/C17H14/c1-3-13-12(2)14-8-4-5-10-16(14)17-11-7-6-9-15(13)17/h3-11H,2H2,1H3/b13-3+.
What are the key properties of (9E)-9-ethylidene-10-methylidenephenanthrene?
(9E)-9-ethylidene-10-methylidenephenanthrene has a molecular weight of 218.30 g/mol, XLogP of 3.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (9E)-9-ethylidene-10-methylidenephenanthrene is sourced from PubChem (CID 142424633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).