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(2Z,4E)-hexa-2,4-dienoic acid

(2Z,4E)-hexa-2,4-dienoic acid

CAS: 110-44-1

Formula: C6H8O2

SMILES: CC=CC=C/C(O)=O

IUPAC: (2Z,4E)-hexa-2,4-dienoic acid

InChI: InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4-

Composition: C (64.27%), H (7.19%), O (28.54%)

Molar Mass: 112.128

Atom Count: 16

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 112.052429498
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WSWCOQWTEOXDQX-IAROGAJJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.28
Topological Polar Surface Area 37.3
Polarizability 11.81
Ring Count 0
Rotatable Bond Count 2

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95% <2 Days 110-44-1 $49.16-$69.92$49.16$57.90$69.92
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