(E)-5-Methyl-2-hexenoic Acid - CAS 51424-01-2

Catalog:	BB027437
Product Name:	(E)-5-Methyl-2-hexenoic Acid
CAS:	51424-01-2
Synonyms:	(E)-5-methyl-2-hexenoic acid; (E)-5-methylhex-2-enoic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	(E)-5-methylhex-2-enoic acid
Description:	(E)-5-Methyl-2-hexenoic Acid (CAS# 51424-01-2 ) is a useful research chemical.
Molecular Weight:	128.17
Molecular Formula:	C7H12O2
Canonical SMILES:	CC(C)CC=CC(=O)O
InChI:	InChI=1S/C7H12O2/c1-6(2)4-3-5-7(8)9/h3,5-6H,4H2,1-2H3,(H,8,9)/b5-3+
InChI Key:	FTHUQCQZQRXJLF-HWKANZROSA-N
LogP:	0.00000

Publication Number	Title	Priority Date
KR-20210116408-A	Composition for removing unwanted molecular	20201005
WO-2021200028-A1	Prepreg, fiber-reinforced composite material, high-pressure gas storage tank, method for producing prepreg, and method for producing high-pressure gas storage tank	20200401
WO-2021157376-A1	Epoxy resin composition, gas barrier multilayer body, retort food packaging material, packaging material for deodorization or aroma retention, heat shrinkable label and method for producing same, heat shrunk label and bottle having same	20200204
CN-110803994-A	Synthetic method of pregabalin intermediate 3-nitromethylene-5-methyl-ethyl hexanoate	20191119
KR-20190105543-A	Composition for removing unwanted molecular	20190902

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Complexity:	114
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	128.083729621
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	128.083729621
Rotatable Bond Count:	3
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8