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17640-26-5 | Acetic acid, 2-ethoxy-, methyl ester
CAS No: 17640-26-5 Catalog No: AG0024NH MDL No:MFCD11173935
Product Description
Catalog Number:
AG0024NH
Chemical Name:
Acetic acid, 2-ethoxy-, methyl ester
CAS Number:
17640-26-5
Molecular Formula:
C5H10O3
Molecular Weight:
118.1311
MDL Number:
MFCD11173935
IUPAC Name:
methyl 2-ethoxyacetate
InChI:
InChI=1S/C5H10O3/c1-3-8-4-5(6)7-2/h3-4H2,1-2H3
InChI Key:
PPFNAOBWGRMDLL-UHFFFAOYSA-N
SMILES:
CCOCC(=O)OC
NSC Number:
294105
Properties
Complexity:
70.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.063g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.132g/mol
Monoisotopic Mass:
118.063g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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