(2E)-2-ethylidene-3,4-dihydrochromene

C11H12O — CID 145341121

IUPAC(2E)-2-ethylidene-3,4-dihydrochromene
SMILESC/C=C1\CCc2ccccc2O1
InChIInChI=1S/C11H12O/c1-2-10-8-7-9-5-3-4-6-11(9)12-10/h2-6H,7-8H2,1H3/b10-2+
InChIKeyCEMXPFZWRIUCSH-WTDSWWLTSA-N
MW160.22 g/mol
LogP2.92
Rot. Bonds

About (2E)-2-ethylidene-3,4-dihydrochromene

(2E)-2-ethylidene-3,4-dihydrochromene (PubChem CID 145341121) has the molecular formula C11H12O and a molecular weight of 160.22 g/mol. Its IUPAC name is (2E)-2-ethylidene-3,4-dihydrochromene.

Molecular Properties

Compound Name(2E)-2-ethylidene-3,4-dihydrochromene
PubChem CID145341121
Molecular FormulaC11H12O
Molecular Weight160.22 g/mol
Exact Mass160.09
IUPAC Name(2E)-2-ethylidene-3,4-dihydrochromene
SMILESC/C=C1\CCc2ccccc2O1
InChIInChI=1S/C11H12O/c1-2-10-8-7-9-5-3-4-6-11(9)12-10/h2-6H,7-8H2,1H3/b10-2+
InChIKeyCEMXPFZWRIUCSH-WTDSWWLTSA-N
XLogP2.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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5,6-dihydro-[1]benzoxepino[2,3-b]pyridine;N-methylmethanamine
CID 165410480
3-methyl-5,6-dihydro-[1]benzoxepino[2,3-b]pyridine
CID 145135593
9H-xanthene
CID 7107
2,3-dihydro-1-benzofuran;ethane
CID 54441538
11-methyl-10,12-dihydrobenzo[b][1,5]benzoxazocine
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bromomethane;2,3-dihydro-1-benzofuran
CID 69259048
2-(3H-1-benzofuran-2-ylidenemethyl)phenol
CID 139847693
N,N-dimethyl-2-oxatricyclo[11.4.0.03,8]heptadeca-1(17),3,5,7,13,15-hexaen-10-amine
CID 143888403
3-ethyl-5,6-dihydro-[1]benzoxepino[2,3-c]pyridine
CID 122491961
3-(2-methylbutan-2-yl)-5,6-dihydro-[1]benzoxepino[3,2-b]pyridine
CID 134218281
2-oxa-11-azatricyclo[13.4.0.03,8]nonadeca-1(19),3,5,7,15,17-hexaene;hydrochloride
CID 20509358

Frequently Asked Questions

What is the IUPAC name of (2E)-2-ethylidene-3,4-dihydrochromene?
The IUPAC name of (2E)-2-ethylidene-3,4-dihydrochromene (CID 145341121) is (2E)-2-ethylidene-3,4-dihydrochromene.
What is the SMILES notation for (2E)-2-ethylidene-3,4-dihydrochromene?
The canonical SMILES for (2E)-2-ethylidene-3,4-dihydrochromene is C/C=C1\CCc2ccccc2O1.
What is the InChIKey of (2E)-2-ethylidene-3,4-dihydrochromene?
The InChIKey is CEMXPFZWRIUCSH-WTDSWWLTSA-N. The full InChI is InChI=1S/C11H12O/c1-2-10-8-7-9-5-3-4-6-11(9)12-10/h2-6H,7-8H2,1H3/b10-2+.
What are the key properties of (2E)-2-ethylidene-3,4-dihydrochromene?
(2E)-2-ethylidene-3,4-dihydrochromene has a molecular weight of 160.22 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-ethylidene-3,4-dihydrochromene is sourced from PubChem (CID 145341121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).