lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride

C11H14Cl2LiOP — CID 174477056

IUPAClithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride
SMILESCCCC(P)C(=O)c1c(Cl)cccc1Cl.[H-].[Li+]
InChIInChI=1S/C11H13Cl2OP.Li.H/c1-2-4-9(15)11(14)10-7(12)5-3-6-8(10)13;;/h3,5-6,9H,2,4,15H2,1H3;;/q;+1;-1
InChIKeyUUVSELNVUUHKBE-UHFFFAOYSA-N
MW271.05 g/mol
LogP1.34
Rot. Bonds4

About lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride

lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride (PubChem CID 174477056) has the molecular formula C11H14Cl2LiOP and a molecular weight of 271.05 g/mol. Its IUPAC name is lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride.

Molecular Properties

Compound Namelithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride
PubChem CID174477056
Molecular FormulaC11H14Cl2LiOP
Molecular Weight271.05 g/mol
Exact Mass270.03
IUPAC Namelithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride
SMILESCCCC(P)C(=O)c1c(Cl)cccc1Cl.[H-].[Li+]
InChIInChI=1S/C11H13Cl2OP.Li.H/c1-2-4-9(15)11(14)10-7(12)5-3-6-8(10)13;;/h3,5-6,9H,2,4,15H2,1H3;;/q;+1;-1
InChIKeyUUVSELNVUUHKBE-UHFFFAOYSA-N
XLogP1.34
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.05
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one
CID 174477057
1-(2,6-dichlorophenyl)-2-methyldodecan-1-one
CID 67779214
1-(2,6-dichlorophenyl)-2-methylpentane-1,4-dione
CID 64706690
N,N-bis[(2R)-butan-2-yl]-2,6-dichlorobenzamide
CID 903787
4-(2,6-dichlorophenyl)-2,3-dimethyl-4-oxobutanoic acid
CID 79415015
1-(2,6-dichlorophenyl)pentan-1-one
CID 83950203
N-(1-amino-1-sulfanylidenepentan-2-yl)-2,6-dichlorobenzamide
CID 61120309
1-(2-chloro-6-hydroxyphenyl)butan-1-one
CID 130034391
1-(2,3-dichlorophenyl)-3-methoxyhexan-2-one
CID 107308025
N-(1-bromopropan-2-yl)-2,6-dichloro-N-methylbenzamide
CID 104556293
CID 159993809
CID 159993809
1-(2,3-dichlorophenyl)-3-hydroxyhexan-2-one
CID 107308073

Frequently Asked Questions

What is the IUPAC name of lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride?
The IUPAC name of lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride (CID 174477056) is lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride.
What is the SMILES notation for lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride?
The canonical SMILES for lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride is CCCC(P)C(=O)c1c(Cl)cccc1Cl.[H-].[Li+].
What is the InChIKey of lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride?
The InChIKey is UUVSELNVUUHKBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2OP.Li.H/c1-2-4-9(15)11(14)10-7(12)5-3-6-8(10)13;;/h3,5-6,9H,2,4,15H2,1H3;;/q;+1;-1.
What are the key properties of lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride?
lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride has a molecular weight of 271.05 g/mol, XLogP of 1.34, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;1-(2,6-dichlorophenyl)-2-phosphanylpentan-1-one;hydride is sourced from PubChem (CID 174477056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).