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1878-62-2 | Acetic acid, 2-(2-acetylphenoxy)-
CAS No: 1878-62-2 Catalog No: AG002GI1 MDL No:MFCD00118956
Product Description
Catalog Number:
AG002GI1
Chemical Name:
Acetic acid, 2-(2-acetylphenoxy)-
CAS Number:
1878-62-2
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00118956
IUPAC Name:
2-(2-acetylphenoxy)acetic acid
InChI:
InChI=1S/C10H10O4/c1-7(11)8-4-2-3-5-9(8)14-6-10(12)13/h2-5H,6H2,1H3,(H,12,13)
InChI Key:
GQZDTCFUDGMSOS-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccccc1C(=O)C
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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