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17509-54-5 | Propanoic acid, 2-(4-methoxyphenoxy)-2-methyl-
CAS No: 17509-54-5 Catalog No: AG00204V MDL No:MFCD03422284
Product Description
Catalog Number:
AG00204V
Chemical Name:
Propanoic acid, 2-(4-methoxyphenoxy)-2-methyl-
CAS Number:
17509-54-5
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
MDL Number:
MFCD03422284
IUPAC Name:
2-(4-methoxyphenoxy)-2-methylpropanoic acid
InChI:
InChI=1S/C11H14O4/c1-11(2,10(12)13)15-9-6-4-8(14-3)5-7-9/h4-7H,1-3H3,(H,12,13)
InChI Key:
TYXBNNMNAWNFHW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OC(C(=O)O)(C)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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