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Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

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CHEMISTRY
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ACTIVE PHARMA INGREDIENTS

1 API Suppliers, 1 USDMF

1 API Suppliers
1 USDMF

Synopsis

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Chemistry

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Also known as: Schembl10035465

Molecular Formula

C₂H₃IO₂

Molecular Weight

185.95 g/mol

InChI Key

MQAKEAYSULFGBL-UHFFFAOYSA-N

1 2D Structure

2-Hydroxyacetyl iodide

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-hydroxyacetyl iodide

2.1.2 InChI

InChI=1S/C2H3IO2/c3-2(5)1-4/h4H,1H2

2.1.3 InChI Key

MQAKEAYSULFGBL-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(C(=O)I)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Schembl10035465

2.3 Create Date

2014-11-03

3 Chemical and Physical Properties

Molecular Formula	C₂H₃IO₂
Molecular Weight	185.95 g/mol
XLogP3	0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	185.91778 g/mol
Monoisotopic Mass	185.91778 g/mol
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	42.9
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