[4-(2-methylpropyl)phenyl]methylphosphane

C11H17P — CID 69020974

IUPAC[4-(2-methylpropyl)phenyl]methylphosphane
SMILESCC(C)Cc1ccc(CP)cc1
InChIInChI=1S/C11H17P/c1-9(2)7-10-3-5-11(8-12)6-4-10/h3-6,9H,7-8,12H2,1-2H3
InChIKeyAWCYFSUKXLABCO-UHFFFAOYSA-N
MW180.23 g/mol
LogP3.26
Rot. Bonds3

About [4-(2-methylpropyl)phenyl]methylphosphane

[4-(2-methylpropyl)phenyl]methylphosphane (PubChem CID 69020974) has the molecular formula C11H17P and a molecular weight of 180.23 g/mol. Its IUPAC name is [4-(2-methylpropyl)phenyl]methylphosphane.

Molecular Properties

Compound Name[4-(2-methylpropyl)phenyl]methylphosphane
PubChem CID69020974
Molecular FormulaC11H17P
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Name[4-(2-methylpropyl)phenyl]methylphosphane
SMILESCC(C)Cc1ccc(CP)cc1
InChIInChI=1S/C11H17P/c1-9(2)7-10-3-5-11(8-12)6-4-10/h3-6,9H,7-8,12H2,1-2H3
InChIKeyAWCYFSUKXLABCO-UHFFFAOYSA-N
XLogP3.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 53.26
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

ethane;4-(2-methylpropyl)benzenethiol
CID 143751683
1-(2-methylpropyl)-4-[1-[4-(2-methylpropyl)phenyl]ethyl]benzene
CID 11044622
1-[4-(2-methylpropyl)phenyl]-N-[[4-(2-methylpropyl)phenyl]methyl]methanamine
CID 101376934
1-ethyl-4-(2-methylpropyl)benzene;methane;propane
CID 154659572
ethane;2-methylpropylbenzene
CID 162200929
1-(2-methylpropyl)-4-(2-phenylethyl)benzene
CID 56625667
ethane;methane;1-(2-methylpropyl)-4-propan-2-ylbenzene
CID 144724990
N'-[4-(2-methylpropyl)phenyl]methanediimine
CID 142719405
1-(2-bromo-3,3-dimethoxypropyl)-4-(2-methylpropyl)benzene
CID 70467158
1-(2-methylpropyl)-4-[4-(2-methylpropyl)phenyl]sulfinylbenzene
CID 139793494
1-[(2S)-1-bromopropan-2-yl]-4-(2-methylpropyl)benzene
CID 11043315
1-(2-methylpropyl)-4-(propan-2-ylsulfanylmethyl)benzene
CID 147950088

Frequently Asked Questions

What is the IUPAC name of [4-(2-methylpropyl)phenyl]methylphosphane?
The IUPAC name of [4-(2-methylpropyl)phenyl]methylphosphane (CID 69020974) is [4-(2-methylpropyl)phenyl]methylphosphane.
What is the SMILES notation for [4-(2-methylpropyl)phenyl]methylphosphane?
The canonical SMILES for [4-(2-methylpropyl)phenyl]methylphosphane is CC(C)Cc1ccc(CP)cc1.
What is the InChIKey of [4-(2-methylpropyl)phenyl]methylphosphane?
The InChIKey is AWCYFSUKXLABCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17P/c1-9(2)7-10-3-5-11(8-12)6-4-10/h3-6,9H,7-8,12H2,1-2H3.
What are the key properties of [4-(2-methylpropyl)phenyl]methylphosphane?
[4-(2-methylpropyl)phenyl]methylphosphane has a molecular weight of 180.23 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylpropyl)phenyl]methylphosphane is sourced from PubChem (CID 69020974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).