MPEG9-CH2COOH

CAT: 0926-FM72926-02Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-FM72926-02Size:250 mg

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

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CAS Number

405518-55-0

Smiles

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCC (=O) O

Molecular Formula

C21H42O12

Molecular Weight

486.55 g/mol

Controlled

Chemical Information

3,6,9,12,15,18,21,24,27,30-Decaoxahentriacontanoic acid

CAS Number	405518-55-0
PubChem CID	10117050
IUPAC Name	2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetic acid
Molecular Formula	C21H42O12
Molecular Weight	486.6
XLogP	-1.7
Topological Polar Surface Area	130
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	29
Heavy Atom Count	33
Formal Charge	0
Complexity	386

SMILES

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)O

InChI

InChI=1S/C21H42O12/c1-24-2-3-25-4-5-26-6-7-27-8-9-28-10-11-29-12-13-30-14-15-31-16-17-32-18-19-33-20-21(22)23/h2-20H2,1H3,(H,22,23)

InChIKey

XVVLEAQJQOTYFV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 405518-55-0

CID: 10117050

Formula: C21H42O12

MW: 486.6

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	486.6
XLogP3	-1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	29
Exact Mass	486.26762677
Monoisotopic Mass	486.26762677
Topological Polar Surface Area	130 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	386
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	1
Compound Is Canonicalized	Yes