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19758-19-1 | Propanoic acid, 3-ethoxy-2-methyl-, ethyl ester
CAS No: 19758-19-1 Catalog No: AG002AWM MDL No:
Product Description
Catalog Number:
AG002AWM
Chemical Name:
Propanoic acid, 3-ethoxy-2-methyl-, ethyl ester
CAS Number:
19758-19-1
Molecular Formula:
C8H16O3
Molecular Weight:
160.2108
IUPAC Name:
ethyl 3-ethoxy-2-methylpropanoate
InChI:
InChI=1S/C8H16O3/c1-4-10-6-7(3)8(9)11-5-2/h7H,4-6H2,1-3H3
InChI Key:
DPBFTBZRGJZMOJ-UHFFFAOYSA-N
SMILES:
CCOCC(C(=O)OCC)C
EC Number:
243-272-8
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.213g/mol
Monoisotopic Mass:
160.11g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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