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3194-55-6

3194-55-6 structural image
Product Name: 1,2,5,6,9,10-Hexabromocyclododecane
Formula: C12H18Br6
Synonyms: HBCD;HBCDD
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Pellets or Large Crystals
Vapor Pressure 0.00000047 [mmHg]
Stability/Shelf Life Stable under recommended storage conditions.
Chemical Classes Plastics & Rubber -> Other Plasticizers

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H361:Reproductive toxicity
H362:Reproductive toxicity, effects on or via lactation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P263:Avoid contact during pregnancy/while nursing.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P273:Avoid release to the environment.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 641.7 g/mol
XLogP3 7.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 0
Exact Mass 641.64473 g/mol
Monoisotopic Mass 635.65088 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 175
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 6
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

1,2,5,6,9,10-hexabromocyclododecane is a bromoalkane consisting of cyclododecane bearing six bromo substituents at positions 1, 2, 5, 6, 9 and 10. It has a role as a neurotoxin, a persistent organic pollutant and a xenobiotic. It is a bromoalkane, a bromohydrocarbon and a brominated flame retardant.