trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane

C12H17P — CID 5463354

IUPACtrimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane
SMILESCP(C)(C)=C/C=C/c1ccccc1
InChIInChI=1S/C12H17P/c1-13(2,3)11-7-10-12-8-5-4-6-9-12/h4-11H,1-3H3/b10-7+
InChIKeyIKNHRICOLDRQQV-JXMROGBWSA-N
MW192.24 g/mol
LogP3.41
Rot. Bonds2

About trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane

trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane (PubChem CID 5463354) has the molecular formula C12H17P and a molecular weight of 192.24 g/mol. Its IUPAC name is trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane.

Molecular Properties

Compound Nametrimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane
PubChem CID5463354
Molecular FormulaC12H17P
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Nametrimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane
SMILESCP(C)(C)=C/C=C/c1ccccc1
InChIInChI=1S/C12H17P/c1-13(2,3)11-7-10-12-8-5-4-6-9-12/h4-11H,1-3H3/b10-7+
InChIKeyIKNHRICOLDRQQV-JXMROGBWSA-N
XLogP3.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-phenylbuta-1,3-dienylbenzene
CID 162273071
[(1Z,3Z)-4-phenylbuta-1,3-dienyl]benzene
CID 139179602
benzene;buta-1,3-dienylbenzene;ethene
CID 174664809
buta-1,3-dienylbenzene;tetrahydrochloride
CID 173415129
[(1Z,3E,5Z,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
CID 124922219
[(1E,3Z)-hexa-1,3,5-trienyl]benzene
CID 12714123
acetaldehyde;buta-1,3-dienylbenzene
CID 173416032
buta-1,3-dienylbenzene;2-methylprop-2-enoic acid
CID 160671566
CID 11087023
CID 11087023
CID 23124540
CID 23124540
azane;1,1'-biphenyl;[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
CID 88641143
carbonic acid;hexa-1,3,5-trienylbenzene
CID 118450762

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane?
The IUPAC name of trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane (CID 5463354) is trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane.
What is the SMILES notation for trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane?
The canonical SMILES for trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane is CP(C)(C)=C/C=C/c1ccccc1.
What is the InChIKey of trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane?
The InChIKey is IKNHRICOLDRQQV-JXMROGBWSA-N. The full InChI is InChI=1S/C12H17P/c1-13(2,3)11-7-10-12-8-5-4-6-9-12/h4-11H,1-3H3/b10-7+.
What are the key properties of trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane?
trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane has a molecular weight of 192.24 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-3-phenylprop-2-enylidene]-lambda5-phosphane is sourced from PubChem (CID 5463354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).