CAS No.14516-71-3,2,2'-Thiobis(4-tert-octylphenolato)-n-butylamine nickel(II) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	14516-71-3
Name:	2,2'-Thiobis(4-tert-octylphenolato)-n-butylamine nickel(II)

Formula:	C₃₂H₅₁NNiO₂S
Molecular Weight:	571.50
Synonyms:	Nickel,(1-butanamine)[[2,2'-thiobis[4-(1,1,3,3-tetramethylbutyl)phenolato]](2-)-O,O',S]-;1-Butanamine, nickel complex;Phenol, 2,2'-thiobis[4-(1,1,3,3-tetramethylbutyl)-,nickel complex;2,2'-Thiobis(4-tert-octylphenoxy)(n-butylamine)nickel;Butylamine[2,2'-thiobis(4-tert-octylphenolato)]nickel;Cyasorb UV 1084;UV 1084;
EINECS:	238-523-3
Density:	1.106[at 20℃]
Boiling Point:	524.8 °C at 760 mmHg
Flash Point:	254.3 °C
Solubility:	204.8μg/L at 20℃
Appearance:	Light green powder
Hazard Symbols:	Xi,T
Risk Codes:	R36/37/38; R25
PSA:	69.29000
LogP:	9.91520

Synthetic route

: 14516-71-3
(C4H9NH2)NiS(OC6H3C8H17)2

: 109-73-9
N-butylamine

: 36393-30-3, 41113-37-5
bis(N-n-butyl-5-methoxysalicylaldiaminato)nickel(II)

Conditions

Conditions	Yield
In methanol stirring (overnight); filtration of crystals, drying (vac.); elem. anal.;

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Chemistry

Molecule structure of 2,2'-Thiobis(4-tert-octylphenolato)-n-butylamine nickel(II) (CAS NO.14516-71-3):

IUPAC Name: Butan-1-amine; nickel(2+);2-[2-oxido-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl-4-(2,4,4-trimethylpentan-2-yl)phenolate
Molecular Weight: 572.51124 g/mol
Molecular Formula: C₃₂H₅₁NNiO₂S
Flash Point: 254.3 °C
Enthalpy of Vaporization: 82.89 kJ/mol
Boiling Point: 524.8 °C at 760 mmHg
Vapour Pressure: 1.24E-11 mmHg at 25 °C
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 10
Exact Mass: 571.299398
MonoIsotopic Mass: 571.299398
Topological Polar Surface Area: 72.1
Heavy Atom Count: 37
Canonical SMILES: CCCCN.CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)[O-])SC2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)[O-].[Ni+2]
InChI: InChI=1S/C28H42O2S.C4H11N.Ni/c1-25(2,3)17-27(7,8)19-11-13-21(29)23(15-19)31-24-16-20(12-14-22(24)30)28(9,10)18-26(4,5)6;1-2-3-4-5;/h11-16,29-30H,17-18H2,1-10H3;2-5H2,1H3;/q;;+2/p-2
InChIKey: DPLLDVMBMPQDCO-UHFFFAOYSA-L
EINECS: 238-523-3
Product Categories of 2,2'-Thiobis(4-tert-octylphenolato)-n-butylamine nickel(II) (CAS NO.14516-71-3): Organometallics

Specification

2,2'-Thiobis(4-tert-octylphenolato)-n-butylamine nickel(II) (CAS NO.14516-71-3) is also named as (Butylamine)((2,2'-thiobis(4-(1,1,3,3-tetramethylbutyl)phenolato))(2-)-O,O',S)nickel ; Nickel, (1-butanamine)((2,2'-(thio-kappaS)bis(4-(1,1,3,3-tetramethylbutyl)phenolato-kappaO))(2-))- ; Nickel, (1-butanamine)((2,2'-thiobis(4-(1,1,3,3-tetramethylbutyl)phenolato))(2-)-O,O',S)- .