Home Other Building Blocks (S)-(+)-2-Methylbutyric acid

(S)-(+)-2-Methylbutyric acid

CAS No.:
1730-91-2
Catalog Number:
AG0032G1
Molecular Formula:
C5H10O2
Molecular Weight:
102.1317
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Product Description
Catalog Number:
AG0032G1
Chemical Name:
(S)-(+)-2-Methylbutyric acid
CAS Number:
1730-91-2
Molecular Formula:
C5H10O2
Molecular Weight:
102.1317
MDL Number:
MFCD00063166
IUPAC Name:
(2S)-2-methylbutanoic acid
InChI:
InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)/t4-/m0/s1
InChI Key:
WLAMNBDJUVNPJU-BYPYZUCNSA-N
SMILES:
C[C@H](C(=O)O)CC
UNII:
5N31513I0N
Properties
Complexity:
68.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
102.068g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
102.133g/mol
Monoisotopic Mass:
102.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Three new resin glycosides and a new tetrahydropyran derivative from the seeds of Quamoclit pennata. Chemical & pharmaceutical bulletin 20120101
Use of a chiral surfactant for enantioselective reduction of a ketone. Journal of colloid and interface science 20040815
Properties