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17640-22-1 | Acetic acid, 2-methoxy-, butyl ester
CAS No: 17640-22-1 Catalog No: AG0024NK MDL No:MFCD16038499
Product Description
Catalog Number:
AG0024NK
Chemical Name:
Acetic acid, 2-methoxy-, butyl ester
CAS Number:
17640-22-1
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
MDL Number:
MFCD16038499
IUPAC Name:
butyl 2-methoxyacetate
InChI:
InChI=1S/C7H14O3/c1-3-4-5-10-7(8)6-9-2/h3-6H2,1-2H3
InChI Key:
IWPATTDMSUYMJV-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)COC
Properties
Complexity:
90.9
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:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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