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ADK Stab NA 21E

CAT: 0572-TRC-A291810-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-A291810-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
151841-65-5
Synonyms
Hydroxybis[2,4,8,10-tetrakis(1,1-dimethylethyl)-6-(hydroxy-κO)-12H-dibenzo[d,g][1,3,2]dioxaphosphocin 6-oxidato]aluminum; 2,2-Methylenebis(4,6-di-tert-butylphenyl)phosphate Aluminum Hydroxide Salt; Aluminium Hydroxy bis[2,2'-Methylene-bis(4,6-di-tert-butylphenyl) phosphate]; Aluminum Hydroxybis[2,2'-methylenebis[4,6-di(tert-butyl)phenyl]phosphate]; Aluminum Methylenebis(2,4-di-tert-butyl-benzyloxy)phosphate; Bis(2,4,8,10-tetra-tert-butyl-6-hydroxy-12H-dibenzo[d,g][1,2,3]dioxaphosphocin-6-oxide) Aluminum Hydroxide Salt; Bis(2,4,8,10-tetra-tert-butyl-6-hydroxy-12H-dibenzo[d,g][1,2,3]dioxaphosphocin-6-oxide)aluminum Hydroxide; Bis(2,4,8,10-tetra-tert-butyl-6-hydroxy-12H-dibenzo[d,g][1,3,2]dioxaphosphocin-6-oxide) Aluminum Hydroxide; Bis[2,2'-methylenebis(4,6-di-tert-butylphenyl) phosphate] Aluminum Hydroxide Salt; HBP; Hydroxyaluminum-bis[2,2-methylene-bis(4,6-di-tert-butylphenyl)phosphate]; NA 13; NA 21E; TMP 5;
Hazard Statement
Not a hazardous substance according to GHS.
Smiles
O=P1(OC2=C(C(C)(C)C)C=C(C(C)(C)C)C=C2CC3=CC(C(C)(C)C)=CC(C(C)(C)C)=C3O1)O[Al](O)OP4(OC5=C(C(C)(C)C)C=C(C(C)(C)C)C=C5CC6=CC(C(C)(C)C)=CC(C(C)(C)C)=C6O4)=O
Molecular Formula
C58H85AlO9P2
Molecular Weight
1015.22
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Aluminium hydroxybis[2,2'-methylen-bis(4,6-di-tert-butylphenyl)phosphate]

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CAS Number151841-65-5
PubChem CID16686081
Molecular FormulaC58H86AlO9P2
Molecular Weight1016.2
Topological Polar Surface Area90.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count12
Heavy Atom Count70
Formal Charge0
Complexity1600
SMILES
CC(C)(C)C1=CC2=C(C(=C1)C(C)(C)C)OP(=O)(OC3=C(C2)C=C(C=C3C(C)(C)C)C(C)(C)C)O[Al]OP4(=O)OC5=C(CC6=C(O4)C(=CC(=C6)C(C)(C)C)C(C)(C)C)C=C(C=C5C(C)(C)C)C(C)(C)C.O
InChI
InChI=1S/2C29H43O4P.Al.H2O/c2*1-26(2,3)20-14-18-13-19-15-21(27(4,5)6)17-23(29(10,11)12)25(19)33-34(30,31)32-24(18)22(16-20)28(7,8)9;;/h2*14-17H,13H2,1-12H3,(H,30,31);;1H2/q;;+2;/p-2
InChIKey
MUBYBLSNBCQXCW-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Aluminium hydroxybis[2,2'-methylen-bis(4,6-di-tert-butylphenyl)phosphate]
CAS: 151841-65-5
CID: 16686081
Formula: C58H86AlO9P2
MW: 1016.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1016.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count12
Exact Mass1015.5562467
Monoisotopic Mass1015.5562467
Topological Polar Surface Area90.5 Ų
Heavy Atom Count70
Formal Charge0
Complexity1600
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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