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1260795-94-5 | Benzeneacetic acid, 4-amino-5-ethoxy-2-methyl-
CAS No: 1260795-94-5 Catalog No: AG000RAM MDL No:
Product Description
Catalog Number:
AG000RAM
Chemical Name:
Benzeneacetic acid, 4-amino-5-ethoxy-2-methyl-
CAS Number:
1260795-94-5
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
IUPAC Name:
2-(4-amino-5-ethoxy-2-methylphenyl)acetic acid
InChI:
InChI=1S/C11H15NO3/c1-3-15-10-5-8(6-11(13)14)7(2)4-9(10)12/h4-5H,3,6,12H2,1-2H3,(H,13,14)
InChI Key:
QDGBGWAKEWMUBQ-UHFFFAOYSA-N
SMILES:
CCOc1cc(CC(=O)O)c(cc1N)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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