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CAT: 0926-FM72960-05Size: 2000 mgDry Ice: NoHazardous: No

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CAT#:0926-FM72960-05Size:2000 mg

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

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CAS Number

651042-82-9

MDL Number

MFCD08274612

Smiles

COCCOCCOCCOCCOCCOCCOCCS

Molecular Formula

C15H32O7S

Molecular Weight

356.48 g/mol

Controlled

Chemical Information

2,5,8,11,14,17,20-Heptaoxadocosane-22-thiol

CAS Number	651042-82-9
PubChem CID	16218250
IUPAC Name	2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol
Molecular Formula	C15H32O7S
Molecular Weight	356.5
XLogP	-0.5
Topological Polar Surface Area	65.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	20
Heavy Atom Count	23
Formal Charge	0
Complexity	210

SMILES

COCCOCCOCCOCCOCCOCCOCCS

InChI

InChI=1S/C15H32O7S/c1-16-2-3-17-4-5-18-6-7-19-8-9-20-10-11-21-12-13-22-14-15-23/h23H,2-15H2,1H3

InChIKey

PVSKDHZQTUFAEZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 651042-82-9

CID: 16218250

Formula: C15H32O7S

MW: 356.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	356.5
XLogP3	-0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	20
Exact Mass	356.18687453
Monoisotopic Mass	356.18687453
Topological Polar Surface Area	65.6 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	210
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