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1103976-11-9 | 2-(dimethylamino)-2-(3-methoxyphenyl) acetic acid
CAS No: 1103976-11-9 Catalog No: AG01F966 MDL No:
Product Description
Catalog Number:
AG01F966
Chemical Name:
2-(dimethylamino)-2-(3-methoxyphenyl) acetic acid
CAS Number:
1103976-11-9
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
IUPAC Name:
2-(dimethylamino)-2-(3-methoxyphenyl)acetic acid
InChI:
InChI=1S/C11H15NO3/c1-12(2)10(11(13)14)8-5-4-6-9(7-8)15-3/h4-7,10H,1-3H3,(H,13,14)
InChI Key:
YGBUDLWPCYKYNQ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(C(=O)O)N(C)C
Properties
Complexity:
218
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:
1
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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