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Methyl 3-methylvalerate

CAS No.:
2177-78-8
Catalog Number:
AG003RT5
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003RT5
Chemical Name:
Methyl 3-methylvalerate
CAS Number:
2177-78-8
MDL Number:
MFCD00024619
IUPAC Name:
methyl 3-methylpentanoate
InChI:
InChI=1S/C7H14O2/c1-4-6(2)5-7(8)9-3/h6H,4-5H2,1-3H3
InChI Key:
FHASOOYJUZKVFW-UHFFFAOYSA-N
Properties
Complexity:
88.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.099g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.187g/mol
Monoisotopic Mass:
130.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Identification of potent odorants in different cultivars of snake fruit [Salacca zalacca (Gaert.) Voss] using gas chromatography-olfactometry. Journal of agricultural and food chemistry 20050309
Properties