Aluminum Octadecanoate

CAT: 0127-OR1012266Size: 1 EachDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1012266Size:1 Each

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

637-12-7

MDL Number

MFCD00036389

Purity

=95%

Smiles

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3]

Notes

8.9-11% Al

Chemical Information

Aluminum Stearate

Aluminium tristearate is an aluminium salt. It contains an octadecanoate.

CAS Number	637-12-7
PubChem CID	12496
IUPAC Name	aluminum tris(octadecanoate)
Molecular Formula	C54H105AlO6
Molecular Weight	877.4
Topological Polar Surface Area	120
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	45
Heavy Atom Count	61
Formal Charge	0
Complexity	196

SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3]

InChI

InChI=1S/3C18H36O2.Al/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h3*2-17H2,1H3,(H,19,20);/q;;;+3/p-3

InChIKey

CEGOLXSVJUTHNZ-UHFFFAOYSA-K

Chemical Structure

2D Structure

CAS: 637-12-7

CID: 12496

Formula: C54H105AlO6

MW: 877.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	877.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	45
Exact Mass	876.7726545
Monoisotopic Mass	876.7726545
Topological Polar Surface Area	120 Å²
Heavy Atom Count	61
Formal Charge	0
Complexity	196
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	4
Compound Is Canonicalized	Yes

Catalog	Name
599018	Lithium octadecanoate
AAA12395-01	Butyl octadecanoate
MBS392544-01	Methyl Octadecanoate
MBS392789-01	Ethyl Octadecanoate
E925951	Ethyl Octadecanoate-d35
S960056	Sodium Octadecanoate-d35
P211156	Potassium Octadecanoate-d35
M326691	Methyl Octadecanoate-d35
449014-01	Ethyl 3- (Benzyloxy) octadecanoate
T886451	Glyceryl Tri(octadecanoate-d35)