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Trans-Hex-2-enoic acid

CAT: 0804-HY-W010531Size: 100 gDry Ice: NoHazardous: No
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CAT#:0804-HY-W010531Size:100 g
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Description
Trans-Hex-2-enoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
CAS Number
13419-69-7
Product Name Alternative
Trans-2-Hexenoic acid
UNSPSC
12352200
Hazard Statement
H314
Target
Biochemical Assay Reagents
Type
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/trans-hex-2-enoic-acid.html
Purity
99.64
Solubility
10 mM in DMSO
Smiles
CCC/C=C/C(O)=O
Molecular Formula
C6H10O2
Molecular Weight
114.14
Precautions
H314
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported

Chemical Information

2-Hexenoic acid, (2E)-

(2E)-hexenoic acid is the (E)-stereoisomer of hexenoic acid. It has a role as a metabolite. It is a conjugate acid of a (2E)-hexenoate.

CAS Number13419-69-7
PubChem CID5282707
IUPAC Name(E)-hex-2-enoic acid
Molecular FormulaC6H10O2
Molecular Weight114.14
XLogP1.6
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count8
Formal Charge0
Complexity94
SMILES
CCC/C=C/C(=O)O
InChI
InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
InChIKey
NIONDZDPPYHYKY-SNAWJCMRSA-N
Chemical Structure
2D Structure
2D structure of 2-Hexenoic acid, (2E)-
CAS: 13419-69-7
CID: 5282707
Formula: C6H10O2
MW: 114.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight114.14
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass114.068079557
Monoisotopic Mass114.068079557
Topological Polar Surface Area37.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity94.7
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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