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Chemistry

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Also known as: 2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80-heptacosaoxadooctacontan-82-ol, Chebi:44817, 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol, Q27120584
Molecular Formula
C55H112O28
Molecular Weight
1221.5  g/mol
InChI Key
ISGUIIHZEJGUGQ-UHFFFAOYSA-N

Lauromacrogol
1 2D Structure

Lauromacrogol

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
2.1.2 InChI
InChI=1S/C55H112O28/c1-57-4-5-59-8-9-61-12-13-63-16-17-65-20-21-67-24-25-69-28-29-71-32-33-73-36-37-75-40-41-77-44-45-79-48-49-81-52-53-83-55-54-82-51-50-80-47-46-78-43-42-76-39-38-74-35-34-72-31-30-70-27-26-68-23-22-66-19-18-64-15-14-62-11-10-60-7-6-58-3-2-56/h56H,2-55H2,1H3
2.1.3 InChI Key
ISGUIIHZEJGUGQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80-heptacosaoxadooctacontan-82-ol

2. Chebi:44817

3. 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

4. Q27120584

2.3 Create Date
2006-01-26
3 Chemical and Physical Properties
Molecular Weight 1221.5 g/mol
Molecular Formula C55H112O28
XLogP3-4.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count28
Rotatable Bond Count80
Exact Mass1220.73401291 g/mol
Monoisotopic Mass1220.73401291 g/mol
Topological Polar Surface Area269 Ų
Heavy Atom Count83
Formal Charge0
Complexity1070
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

API SUPPLIERS

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NOF CORPORATION

Japan

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NOF CORPORATION

Japan

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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NOF CORPORATION

Japan

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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NOF CORPORATION

Japan

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NOF CORPORATION

Japan

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04

NOF CORPORATION

Japan

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NOF CORPORATION

Japan

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05

NOF CORPORATION

Japan

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NOF CORPORATION

Japan

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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06

NOF CORPORATION

Japan

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

DDL Conference
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NOF CORPORATION

Japan

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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07

NOF CORPORATION

Japan

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NOF CORPORATION

Japan

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Sumitomo Seika Chemicals

Japan

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Sumitomo Seika Chemicals

Japan

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Avesta Pharma

India

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Avesta Pharma

India

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10

The Dow Chemical Company

U.S.A

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The Dow Chemical Company

U.S.A

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