butan-2-yl-bis(2-methylpentan-2-yl)phosphane

C16H35P — CID 139972821

IUPACbutan-2-yl-bis(2-methylpentan-2-yl)phosphane
SMILESCCCC(C)(C)P(C(C)CC)C(C)(C)CCC
InChIInChI=1S/C16H35P/c1-9-12-15(5,6)17(14(4)11-3)16(7,8)13-10-2/h14H,9-13H2,1-8H3
InChIKeyWFEAERXXIGZXBS-UHFFFAOYSA-N
MW258.43 g/mol
LogP6.42
Rot. Bonds8

About butan-2-yl-bis(2-methylpentan-2-yl)phosphane

butan-2-yl-bis(2-methylpentan-2-yl)phosphane (PubChem CID 139972821) has the molecular formula C16H35P and a molecular weight of 258.43 g/mol. Its IUPAC name is butan-2-yl-bis(2-methylpentan-2-yl)phosphane.

Molecular Properties

Compound Namebutan-2-yl-bis(2-methylpentan-2-yl)phosphane
PubChem CID139972821
Molecular FormulaC16H35P
Molecular Weight258.43 g/mol
Exact Mass258.25
IUPAC Namebutan-2-yl-bis(2-methylpentan-2-yl)phosphane
SMILESCCCC(C)(C)P(C(C)CC)C(C)(C)CCC
InChIInChI=1S/C16H35P/c1-9-12-15(5,6)17(14(4)11-3)16(7,8)13-10-2/h14H,9-13H2,1-8H3
InChIKeyWFEAERXXIGZXBS-UHFFFAOYSA-N
XLogP6.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.43
LogP ≤ 56.42
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

ethyl-methyl-(2-methylpentan-2-yl)phosphane
CID 91467779
4,6,8-trimethylnonan-4-ol
CID 54063112
3-methyl-3-propylhexan-2-ol
CID 20501676
(3S)-3-fluoro-2,3-dimethylhexane
CID 169026252
(3S)-3-ethyl-2,3-dimethylhexane
CID 158040075
(2R)-1-amino-2-methylpentan-2-ol
CID 51381277
sodium;hydride;3-methylhexan-3-ol
CID 175384887
3-methyl-3-propylhexane-2-thiol
CID 123142515
(3S)-5-ethyl-3,5-dimethyloctane
CID 143713459
2,4-dimethyl-3-propylhexane-2,3-diol
CID 69305500
2-methyl-1-(2-propan-2-ylsulfonylethylamino)pentan-2-ol
CID 106293022
4,4-dimethylheptane-3-thiol
CID 174721074

Frequently Asked Questions

What is the IUPAC name of butan-2-yl-bis(2-methylpentan-2-yl)phosphane?
The IUPAC name of butan-2-yl-bis(2-methylpentan-2-yl)phosphane (CID 139972821) is butan-2-yl-bis(2-methylpentan-2-yl)phosphane.
What is the SMILES notation for butan-2-yl-bis(2-methylpentan-2-yl)phosphane?
The canonical SMILES for butan-2-yl-bis(2-methylpentan-2-yl)phosphane is CCCC(C)(C)P(C(C)CC)C(C)(C)CCC.
What is the InChIKey of butan-2-yl-bis(2-methylpentan-2-yl)phosphane?
The InChIKey is WFEAERXXIGZXBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35P/c1-9-12-15(5,6)17(14(4)11-3)16(7,8)13-10-2/h14H,9-13H2,1-8H3.
What are the key properties of butan-2-yl-bis(2-methylpentan-2-yl)phosphane?
butan-2-yl-bis(2-methylpentan-2-yl)phosphane has a molecular weight of 258.43 g/mol, XLogP of 6.42, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl-bis(2-methylpentan-2-yl)phosphane is sourced from PubChem (CID 139972821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).