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13211-32-0 | Acetic acid, 2-(1,1-dimethylethoxy)-
CAS No: 13211-32-0 Catalog No: AG001088 MDL No:MFCD03452738
Product Description
Catalog Number:
AG001088
Chemical Name:
Acetic acid, 2-(1,1-dimethylethoxy)-
CAS Number:
13211-32-0
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
MDL Number:
MFCD03452738
IUPAC Name:
2-[(2-methylpropan-2-yl)oxy]acetic acid
InChI:
InChI=1S/C6H12O3/c1-6(2,3)9-4-5(7)8/h4H2,1-3H3,(H,7,8)
InChI Key:
HQLILHPGWSURBT-UHFFFAOYSA-N
SMILES:
OC(=O)COC(C)(C)C
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Isotope Atom Count:
0
Molecular Weight:
132.159g/mol
Monoisotopic Mass:
132.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Antitumor activities and interaction with DNA of oxaliplatin-type platinum complexes with linear or branched alkoxyacetates as leaving groups. | Journal of inorganic biochemistry 20110801 |
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