Cis-3-Hexen-1-ol 97%

CAT: 0286-H05810-01Size: 10 gDry Ice: NoHazardous: Yes

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CAT#:0286-H05810-01Size:10 g

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CAS Number

928-96-1

Synonyms

Leaf alcohol

UN Code

UN1987

Pictogram

02 - Flammable; 07 - Irritant

UDF Signal Word

Warning

MDL Number

MFCD00063217

Hazard Statement

H226 Flammable liquid and vapor; H302 Harmful if swallowed; 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

Alcohols, N.O.S.

DOT Classification

Class 3

Packaging Group

PGIII

Precautions

P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; 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; P332+P313 IF SKIN irritation occurs: Get medical advice/attention; P403+P235 Store in a well-ventilated place. Keep cool.

Chemical Information

3-Hexenol

(Z)-hex-3-en-1-ol is a hex-3-en-1-ol in which the double bond adopts a Z-configuration. Also known as leaf alcohol, it is emitted by green plants upon mechanical damage. Used as a flavourant in tea. It has a role as an insect attractant, a fragrance and a plant metabolite.

CAS Number	928-96-1
PubChem CID	5281167
IUPAC Name	(Z)-hex-3-en-1-ol
Molecular Formula	C6H12O
Molecular Weight	100.16
XLogP	1.3
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	48

SMILES

CC/C=C\CCO

InChI

InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3-

InChIKey

UFLHIIWVXFIJGU-ARJAWSKDSA-N

Chemical Structure

2D Structure

CAS: 928-96-1

CID: 5281167

Formula: C6H12O

MW: 100.16

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	100.16
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	100.088815002
Monoisotopic Mass	100.088815002
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	48.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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H05820-01	4-Hexen-3-ol
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Alternative Products

Catalog	Name
C7154-500	cis-3-Hexen-1-ol
TRC-H295007-250MG	cis-3-Hexen-1-ol-D2
AR-H07554-01	Cis-3-Hexen-1-ol-d5
HY-W010607R-01	Cis-3-Hexen-1-ol (Standard)
TRC-H293635-10G	cis-2-Hexen-1-ol
sc-211109A	Cis-4-Hexen-1-ol

Cis-3-Hexen-1-ol 97%

Chemical Information

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