2-Di-tert-butylphosphino-3,4,5,6-tetram&

C₃₃H₅₃PCAS 857356-94-6480.76 g/mol

Open in Covalent MOL file

Phosphine

Properties

Molecular formula: C₃₃H₅₃P
Molar mass: 480.76 g/mol
Exact mass: 480.3885 Da
logP: 10.66Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers
H412 Harmful to aquatic life with long lasting effects50% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

857356-94-6

SMILES

CC1=C(C(=C(C(=C1C)C2=C(C=C(C=C2C(C)C)C(C)C)C(C)C)P(C(C)(C)C)C(C)(C)C)C)C

InChIKey

RCRYEYMHBHPZQD-UHFFFAOYSA-N

InChI

InChI=1S/C33H53P/c1-19(2)26-17-27(20(3)4)30(28(18-26)21(5)6)29-24(9)22(7)23(8)25(10)31(29)34(32(11,12)13)33(14,15)16/h17-21H,1-16H3

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Names and synonyms

1 names

Di-tert-butyl[3,4,5,6-tetramethyl-2',4',6'-tris(propan-2-yl)-[1,1'-biphenyl]-2-yl]phosphane

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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

Similar compounds

2-(Di-T-butylphosphino)-3-methoxy-6-methyl-2',4',6'-tri-I-propyl-1,1'-biphenyl1262046-34-355 % similar Di-tert-butyl(2',4',6'-tris(propan-2-yl)-(1,1'-biphenyl)-2-yl)phosphane564483-19-851 % similar AdBrettPhos1160861-59-538 % similar 1-Bromo-2,4,6-triisopropylbenzene21524-34-535 % similar Dicyclohexyl[3,6-dimethoxy-2′,4′,6′-tris(1-methylethyl)[1,1′-biphenyl]-2-yl]phosphine1070663-78-335 % similar 1-[2,4,6-Tris(1-methylethyl)phenyl]ethanone2234-14-234 % similar 2-Bromo-2',4',6'-triisopropyl-3,6-dimethoxy-1,1'-biphenyl1402393-56-934 % similar Diphenyl(2',4',6'-tris(1-methylethyl)(1,1'-biphenyl)-2-yl)-phosphine819867-23-734 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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