Butyldi-1-adamantylphosphine

C₂₄H₃₉PCAS 321921-71-5358.55 g/mol

Open in Covalent MOL file

Phosphine

Properties

Molecular formula: C₂₄H₃₉P
Molar mass: 358.55 g/mol
Exact mass: 358.2789 Da
logP: 7.21Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed42.9% of notifiers
H315 Causes skin irritation71.4% of notifiers
H319 Causes serious eye irritation71.4% of notifiers
H332 Harmful if inhaled14.3% of notifiers
H335 May cause respiratory irritation71.4% of notifiers

Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

321921-71-5

SMILES

CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5

InChIKey

HTJWUNNIRKDDIV-UHFFFAOYSA-N

InChI

InChI=1S/C24H39P/c1-2-3-4-25(23-11-17-5-18(12-23)7-19(6-17)13-23)24-14-20-8-21(15-24)10-22(9-20)16-24/h17-22H,2-16H2,1H3

Weigh it out

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Names and synonyms

1 names

Bis(adamantan-1-yl)(butyl)phosphane

Work with Butyldi-1-adamantylphosphine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

CataCXium A hydroiodide714951-87-8Salt

Similar compounds

Tributylphosphine998-40-338 % similar DI(1-Adamantyl)benzylphosphine395116-70-837 % similar 1-Ethyladamantane770-69-434 % similar Dichlorobis(tributylphosphine)nickel(II)15274-43-832 % similar Butylcyclopentane2040-95-132 % similar Butylcyclohexane1678-93-931 % similar Trihexylphosphine4168-73-431 % similar Pentylcyclohexane4292-92-631 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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