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628-16-0

628-16-0 structural image
Product Name: 1,5-HEXADIYNE
Formula: C6H6
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Clear liquid; [MSDSonline] Boiling point = 86 deg C; [ChemIDplus]
Kovats Retention Index 680
Chemical Classes Other Classes -> Aliphatics, Unsaturated

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H225:Flammable liquids
H304:Aspiration hazard
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H336:Specific target organ toxicity,single exposure; Narcotic effects
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 78.11 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 1
Exact Mass 78.0469501914 g/mol
Monoisotopic Mass 78.0469501914 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 86.5
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

PRODUCT INTRODUCTION

description

Hexa-1,5-diyne is an alkadiyne and a terminal acetylenic compound.