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Reference substances

Reference substances

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General information

Inventory

EC number:
238-523-3
EC name:
(butylamine)[[2,2'-thiobis[4-(1,1,3,3-tetramethylbutyl)phenolato]](2-)-O,O',S]nickel
CAS number:
14516-71-3

No inventory information available

Reference substance information

IUPAC name:
nickel(2+) ion butan-1-amine 2-{[2-oxido-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl}-4-(2,4,4-trimethylpentan-2-yl)benzen-1-olate
Synonyms
Names:
Identifier:
CAS number
14516-71-3
Identifier:
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
Identifier:
other: SMILES notation
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]
Identifier:
other: InChl
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
2-(2H-benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenol

CAS information

CAS number:
14516-71-3

Molecular and structural information

Molecular formula:
C32H51NNiO2S
Molecular weight:
572.5
SMILES notation:
not applicable
InChl:
not applicable
Structural formula:
Chemical structure