methylidene(2,5,5-trimethylhexan-2-yl)phosphane

C10H21P — CID 90713071

IUPACmethylidene(2,5,5-trimethylhexan-2-yl)phosphane
SMILESC=PC(C)(C)CCC(C)(C)C
InChIInChI=1S/C10H21P/c1-9(2,3)7-8-10(4,5)11-6/h6-8H2,1-5H3
InChIKeyQSUZGZPFRNBALK-UHFFFAOYSA-N
MW172.25 g/mol
LogP3.97
Rot. Bonds3

About methylidene(2,5,5-trimethylhexan-2-yl)phosphane

methylidene(2,5,5-trimethylhexan-2-yl)phosphane (PubChem CID 90713071) has the molecular formula C10H21P and a molecular weight of 172.25 g/mol. Its IUPAC name is methylidene(2,5,5-trimethylhexan-2-yl)phosphane.

Molecular Properties

Compound Namemethylidene(2,5,5-trimethylhexan-2-yl)phosphane
PubChem CID90713071
Molecular FormulaC10H21P
Molecular Weight172.25 g/mol
Exact Mass172.14
IUPAC Namemethylidene(2,5,5-trimethylhexan-2-yl)phosphane
SMILESC=PC(C)(C)CCC(C)(C)C
InChIInChI=1S/C10H21P/c1-9(2,3)7-8-10(4,5)11-6/h6-8H2,1-5H3
InChIKeyQSUZGZPFRNBALK-UHFFFAOYSA-N
XLogP3.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 53.97
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

3,3-dimethylbutan-1-amine;hydroiodide
CID 173144991
(3S)-3-dimethylsilyl-3-hydroxy-2,2,6,6-tetramethylheptanenitrile
CID 173113122
2,2-dimethylpropane;2-methyl-2-methylbutane;2,2,5,5-tetramethylhexane
CID 157119351
molecular hydrogen;2,2,6,6-tetramethylheptane
CID 169194475
barium(2+);hydride;2,2,6,6-tetramethylheptane
CID 173027218
bis(2,2-dimethylpentane);methane
CID 159859974
8-ethyl-2,2,5,5-tetramethyldecane
CID 91134547
4,4-difluoro-2,2,7,7-tetramethyloctane
CID 169306156
2,5,5-trimethylhexan-2-yl hypoiodite
CID 130279659
4,4-dimethylpentan-1-amine
CID 14454757
2,2-dimethylhexane
CID 169424592
3,3-dimethylbutan-1-ol;ethane
CID 155708762

Frequently Asked Questions

What is the IUPAC name of methylidene(2,5,5-trimethylhexan-2-yl)phosphane?
The IUPAC name of methylidene(2,5,5-trimethylhexan-2-yl)phosphane (CID 90713071) is methylidene(2,5,5-trimethylhexan-2-yl)phosphane.
What is the SMILES notation for methylidene(2,5,5-trimethylhexan-2-yl)phosphane?
The canonical SMILES for methylidene(2,5,5-trimethylhexan-2-yl)phosphane is C=PC(C)(C)CCC(C)(C)C.
What is the InChIKey of methylidene(2,5,5-trimethylhexan-2-yl)phosphane?
The InChIKey is QSUZGZPFRNBALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21P/c1-9(2,3)7-8-10(4,5)11-6/h6-8H2,1-5H3.
What are the key properties of methylidene(2,5,5-trimethylhexan-2-yl)phosphane?
methylidene(2,5,5-trimethylhexan-2-yl)phosphane has a molecular weight of 172.25 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylidene(2,5,5-trimethylhexan-2-yl)phosphane is sourced from PubChem (CID 90713071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).