Home Other Building Blocks (S)-2-Hydroxy-3,3-dimethylbutanoic acid

(S)-2-Hydroxy-3,3-dimethylbutanoic acid

CAS No.:
21641-92-9
Catalog Number:
AG003CDN
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
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Product Description
Catalog Number:
AG003CDN
Chemical Name:
(S)-2-Hydroxy-3,3-dimethylbutanoic acid
CAS Number:
21641-92-9
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
MDL Number:
MFCD00192212
IUPAC Name:
(2S)-2-hydroxy-3,3-dimethylbutanoic acid
InChI:
InChI=1S/C6H12O3/c1-6(2,3)4(7)5(8)9/h4,7H,1-3H3,(H,8,9)/t4-/m1/s1
InChI Key:
FWVNWTNCNWRCOU-SCSAIBSYSA-N
SMILES:
O[C@@H](C(C)(C)C)C(=O)O
Properties
Complexity:
112  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
132.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.159g/mol
Monoisotopic Mass:
132.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties