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1156266-82-8 | [Methyl-(3-methyl-benzyl)-amino]-acetic acid
CAS No: 1156266-82-8 Catalog No: AG01FAJW MDL No:
Product Description
Catalog Number:
AG01FAJW
Chemical Name:
[Methyl-(3-methyl-benzyl)-amino]-acetic acid
CAS Number:
1156266-82-8
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
IUPAC Name:
2-[methyl-[(3-methylphenyl)methyl]amino]acetic acid
InChI:
InChI=1S/C11H15NO2/c1-9-4-3-5-10(6-9)7-12(2)8-11(13)14/h3-6H,7-8H2,1-2H3,(H,13,14)
InChI Key:
SWJLSEPEYJWQBQ-UHFFFAOYSA-N
SMILES:
CN(Cc1cccc(c1)C)CC(=O)O
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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