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17640-23-2 | Acetic acid, 2-methoxy-, 1,1-dimethylethyl ester
CAS No: 17640-23-2 Catalog No: AG0024NJ MDL No:
Product Description
Catalog Number:
AG0024NJ
Chemical Name:
Acetic acid, 2-methoxy-, 1,1-dimethylethyl ester
CAS Number:
17640-23-2
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
IUPAC Name:
tert-butyl 2-methoxyacetate
InChI:
InChI=1S/C7H14O3/c1-7(2,3)10-6(8)5-9-4/h5H2,1-4H3
InChI Key:
JSWGISCKHSCBGX-UHFFFAOYSA-N
SMILES:
COCC(=O)OC(C)(C)C
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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