(2E)-2-cyclohexa-2,4-dien-1-ylideneethanol

C8H10O — CID 14764376

IUPAC(2E)-2-cyclohexa-2,4-dien-1-ylideneethanol
SMILESOC/C=C1/C=CC=CC1
InChIInChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-4,6,9H,5,7H2/b8-6-
InChIKeyQQMBPUQAIKCONA-VURMDHGXSA-N
MW122.17 g/mol
LogP1.42
Rot. Bonds1

About (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol

(2E)-2-cyclohexa-2,4-dien-1-ylideneethanol (PubChem CID 14764376) has the molecular formula C8H10O and a molecular weight of 122.17 g/mol. Its IUPAC name is (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol.

Molecular Properties

Compound Name(2E)-2-cyclohexa-2,4-dien-1-ylideneethanol
PubChem CID14764376
Molecular FormulaC8H10O
Molecular Weight122.17 g/mol
Exact Mass122.07
IUPAC Name(2E)-2-cyclohexa-2,4-dien-1-ylideneethanol
SMILESOC/C=C1/C=CC=CC1
InChIInChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-4,6,9H,5,7H2/b8-6-
InChIKeyQQMBPUQAIKCONA-VURMDHGXSA-N
XLogP1.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-Nonadien-1-ol
CID 112492
2,4-Octadien-1-ol, (2E,4E)-
CID 6436488
(Z)-2-Methyl-6-methylene-2,7-octadien-1-ol
CID 5319723
(2E,4E)-Nona-2,4-dien-1-ol
CID 5364586
(2E,6E,10E,12E)-3,7,11,15-tetramethylhexadeca-2,6,10,12,14-pentaen-1-ol
CID 10469408
2-Cyclohexylideneethanol
CID 70271
(2Z)-2-methyl-6-methylideneocta-2,7-dien-1-ol
CID 5352139
trans-Ocimenol
CID 6430998
Octa-2,4-dien-1-ol
CID 87631
3-Methylhepta-2,6-dien-1-ol
CID 11446327
(2xi,4xi)-2,4-Nonadien-1-ol
CID 12385644
2,4-Dimethyl-2E,4E-heptadien-1-ol
CID 44256514

Frequently Asked Questions

What is the IUPAC name of (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol?
The IUPAC name of (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol (CID 14764376) is (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol.
What is the SMILES notation for (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol?
The canonical SMILES for (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol is OC/C=C1/C=CC=CC1.
What is the InChIKey of (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol?
The InChIKey is QQMBPUQAIKCONA-VURMDHGXSA-N. The full InChI is InChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-4,6,9H,5,7H2/b8-6-.
What are the key properties of (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol?
(2E)-2-cyclohexa-2,4-dien-1-ylideneethanol has a molecular weight of 122.17 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-cyclohexa-2,4-dien-1-ylideneethanol is sourced from PubChem (CID 14764376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).