Diallyl

CAT: 0286-D03200-01Size: 25 gDry Ice: NoHazardous: Yes

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CAT#:0286-D03200-01Size:25 g

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CAS Number

592-42-7

Synonyms

Biallyl; 1,5-Hexadiene

UN Code

UN2458

Pictogram

02 - Flammable; 07 - Irritant; 08 - Health Hazard

UDF Signal Word

Danger

MDL Number

MFCD00008666

Hazard Statement

H225 Highly flammable liquid and vapor; H304 May be fatal if swallowed and enters airways; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.

DOT Name

Hexadienes

DOT Classification

Class 3

Packaging Group

PGII

Precautions

P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; P240 Ground/bond container and receiving equipment; P241 Use explosion-proof electrical/ventilating/lighting/[ ]/equipment; P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P310 IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P331 Do NOT induce vomiting; P332+P313 IF SKIN irritation occurs: Get medical advice/attention; P403+P235 Store in a well-ventilated place. Keep cool.

Chemical Information

1,5-Hexadiene

structure in first source

CAS Number	592-42-7
PubChem CID	11598
IUPAC Name	hexa-1,5-diene
Molecular Formula	C6H10
Molecular Weight	82.14
XLogP	2.9
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	3
Heavy Atom Count	6
Formal Charge	0
Complexity	36

SMILES

C=CCCC=C

InChI

InChI=1S/C6H10/c1-3-5-6-4-2/h3-4H,1-2,5-6H2

InChIKey

PYGSKMBEVAICCR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 592-42-7

CID: 11598

Formula: C6H10

MW: 82.14

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	82.14
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	3
Exact Mass	82.078250319
Monoisotopic Mass	82.078250319
Topological Polar Surface Area	0 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	36
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

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