Home Carboxys 2-(tert-butyl carboxy)-3,3-dimethylbutanoic acid

2-(tert-butyl carboxy)-3,3-dimethylbutanoic acid

CAS No.:
1955494-78-6
Catalog Number:
AG01C6KG
Molecular Formula:
C11H20O4
Molecular Weight:
216.2741
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Product Description
Catalog Number:
AG01C6KG
Chemical Name:
2-(tert-butyl carboxy)-3,3-dimethylbutanoic acid
CAS Number:
1955494-78-6
Molecular Formula:
C11H20O4
Molecular Weight:
216.2741
MDL Number:
MFCD29991521
IUPAC Name:
3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonyl]butanoic acid
InChI:
InChI=1S/C11H20O4/c1-10(2,3)7(8(12)13)9(14)15-11(4,5)6/h7H,1-6H3,(H,12,13)
InChI Key:
QFXNKBXOFLOXRG-UHFFFAOYSA-N
SMILES:
OC(=O)C(C(C)(C)C)C(=O)OC(C)(C)C
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.136g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.277g/mol
Monoisotopic Mass:
216.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties