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1353978-53-6 | [Methyl-(1-pyridin-2-yl-ethyl)-amino]-acetic acid
CAS No: 1353978-53-6 Catalog No: AG01F99V MDL No:
Product Description
Catalog Number:
AG01F99V
Chemical Name:
[Methyl-(1-pyridin-2-yl-ethyl)-amino]-acetic acid
CAS Number:
1353978-53-6
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
IUPAC Name:
2-[methyl(1-pyridin-2-ylethyl)amino]acetic acid
InChI:
InChI=1S/C10H14N2O2/c1-8(12(2)7-10(13)14)9-5-3-4-6-11-9/h3-6,8H,7H2,1-2H3,(H,13,14)
InChI Key:
PSABBLIBEQOPIT-UHFFFAOYSA-N
SMILES:
OC(=O)CN(C(c1ccccn1)C)C
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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