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Safety Information

193097

Sigma-Aldrich

trans-3-Hexenoic acid

97%

Synonym(s):

(3E)-3-Hexenoic acid, (3E)-Hex-3-enoic acid, (E)-3-Hexenoic acid, (E)-Hex-3-enoic acid, 3(E)-Hexenoic acid

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About This Item

Linear Formula:
C2H5CH=CHCH2CO2H
CAS Number:
1577-18-0
Molecular Weight:
114.14
EC Number:
216-417-8
MDL number:
MFCD00002786
UNSPSC Code:
12352100
PubChem Substance ID:
24851580
NACRES:
NA.22

vapor density

>1 (vs air)

Quality Level

100

Assay

97%

form

liquid

refractive index

n20/D 1.44 (lit.)

bp

118-119 °C/22 mmHg (lit.)

mp

11-12 °C (lit.)

density

0.963 g/mL at 25 °C (lit.)

functional group

carboxylic acid

SMILES string

CC\C=C\CC(O)=O

InChI

1S/C6H10O2/c1-2-3-4-5-6(7)8/h3-4H,2,5H2,1H3,(H,7,8)/b4-3+

InChI key

XXHDAWYDNSXJQM-ONEGZZNKSA-N

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Application

trans-3-Hexenoic acid was used in the preparation of trans-3-hexen-1-ol, starting reagent for the synthesis of endo-brevicomin.

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Skin Corr. 1B

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

193097-BULK:
193097-10G:
193097-VAR:
193097-50G:

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Certificates of Analysis (COA)

Lot/Batch Number
SHBN9419
SHBN8773
SHBN3895
SHBL7767
MKBK0121V

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