(1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol

C19H17OP — CID 134941801

IUPAC(1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol
SMILESC/C(O)=C1/C=CC=C1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17OP/c1-15(20)18-13-8-14-19(18)21(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,20H,1H3/b18-15+
InChIKeyRVOYVAOGHCQWQI-OBGWFSINSA-N
MW292.32 g/mol
LogP4.41
Rot. Bonds3

About (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol

(1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol (PubChem CID 134941801) has the molecular formula C19H17OP and a molecular weight of 292.32 g/mol. Its IUPAC name is (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol.

Molecular Properties

Compound Name(1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol
PubChem CID134941801
Molecular FormulaC19H17OP
Molecular Weight292.32 g/mol
Exact Mass292.10
IUPAC Name(1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol
SMILESC/C(O)=C1/C=CC=C1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17OP/c1-15(20)18-13-8-14-19(18)21(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,20H,1H3/b18-15+
InChIKeyRVOYVAOGHCQWQI-OBGWFSINSA-N
XLogP4.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

gold(3+);triphenylphosphane;triacetate
CID 160881940
palladium;bis(triphenylphosphane)
CID 10122028
pentakis(palladium);hexadecakis(triphenylphosphane)
CID 173116735
acetic acid;chlororuthenium;tris(triphenylphosphane)
CID 172641403
hypochlorous acid;ruthenium;tris(triphenylphosphane)
CID 160643547
acetic acid;triphenylphosphane;hydrochloride
CID 87530977
propan-2-one;triphenylphosphane;hydrate
CID 118484852
palladium;ruthenium;triphenylphosphane
CID 174683160
methane;palladium;triphenylphosphane
CID 90407786
ethane;triphenylphosphane
CID 90942156
nickel(2+);tris(triphenylphosphane);diiodide
CID 173453506
triphenylphosphane
CID 139056248

Frequently Asked Questions

What is the IUPAC name of (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol?
The IUPAC name of (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol (CID 134941801) is (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol.
What is the SMILES notation for (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol?
The canonical SMILES for (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol is C/C(O)=C1/C=CC=C1P(c1ccccc1)c1ccccc1.
What is the InChIKey of (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol?
The InChIKey is RVOYVAOGHCQWQI-OBGWFSINSA-N. The full InChI is InChI=1S/C19H17OP/c1-15(20)18-13-8-14-19(18)21(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,20H,1H3/b18-15+.
What are the key properties of (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol?
(1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol has a molecular weight of 292.32 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-ylidene)ethanol is sourced from PubChem (CID 134941801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).