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13887-98-4

13887-98-4 structural image
Product Name: 3,6,9-TRIOXAUNDECANEDIOIC ACID
Formula: C8H14O7
Synonyms: O,O′-Oxydiethylene-diglycolic acid
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05
GHS Hazard Statements H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 222.19 g/mol
XLogP3 -1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 10
Exact Mass 222.07395278 g/mol
Monoisotopic Mass 222.07395278 g/mol
Topological Polar Surface Area 102 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 171
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