(1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol

C10H12O — CID 134983494

IUPAC(1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol
SMILESC=c1cccc/c1=C\C(C)O
InChIInChI=1S/C10H12O/c1-8-5-3-4-6-10(8)7-9(2)11/h3-7,9,11H,1H2,2H3/b10-7+
InChIKeyZCFPKHPXLPJKDC-JXMROGBWSA-N
MW148.20 g/mol
LogP0.26
Rot. Bonds1

About (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol

(1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol (PubChem CID 134983494) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol.

Molecular Properties

Compound Name(1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol
PubChem CID134983494
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name(1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol
SMILESC=c1cccc/c1=C\C(C)O
InChIInChI=1S/C10H12O/c1-8-5-3-4-6-10(8)7-9(2)11/h3-7,9,11H,1H2,2H3/b10-7+
InChIKeyZCFPKHPXLPJKDC-JXMROGBWSA-N
XLogP0.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(iodomethylidene)-6-methylidenecyclohexa-1,3-diene
CID 159580103
ethane;(6Z)-5-methylidene-6-propylidenecyclohexa-1,3-diene
CID 145022062
(6Z)-5-methylidene-6-prop-2-enylidenecyclohexa-1,3-diene
CID 59733889
lithium (E)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)methanolate
CID 102416315
(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene
CID 143026657
ethane;N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)methyl]ethanimine
CID 143906186
(5Z)-5-[(2Z)-2-methoxy-3-methylpenta-2,4-dienylidene]-6-methylidenecyclohexa-1,3-diene
CID 142154594
(Z,5Z)-2-methyl-5-(6-methylidenecyclohexa-2,4-dien-1-ylidene)pent-3-en-2-amine
CID 89200532
benzene-1,2-diol;propan-2-ol
CID 144664669
(Z,2R)-4-phenylbut-3-en-2-ol
CID 11457765
1-(4-phenylcyclohexylidene)propan-2-ol
CID 103971296
1,2-di(propan-2-yl)benzene;1-sulfanylethanol
CID 174932639

Frequently Asked Questions

What is the IUPAC name of (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol?
The IUPAC name of (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol (CID 134983494) is (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol.
What is the SMILES notation for (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol?
The canonical SMILES for (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol is C=c1cccc/c1=C\C(C)O.
What is the InChIKey of (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol?
The InChIKey is ZCFPKHPXLPJKDC-JXMROGBWSA-N. The full InChI is InChI=1S/C10H12O/c1-8-5-3-4-6-10(8)7-9(2)11/h3-7,9,11H,1H2,2H3/b10-7+.
What are the key properties of (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol?
(1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol has a molecular weight of 148.20 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)propan-2-ol is sourced from PubChem (CID 134983494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).