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Home > Pyridines > 1315173-05-7
1315173-05-7 | N-methyl-N-(2-pyridinylmethyl)glycine dihydrochloride hydrate
CAS No: 1315173-05-7 Catalog No: AG00J10Q MDL No:MFCD13193824
Product Description
Catalog Number:
AG00J10Q
Chemical Name:
N-methyl-N-(2-pyridinylmethyl)glycine dihydrochloride hydrate
CAS Number:
1315173-05-7
Molecular Formula:
C9H16Cl2N2O3
Molecular Weight:
271.1409
MDL Number:
MFCD13193824
IUPAC Name:
2-[methyl(pyridin-2-ylmethyl)amino]acetic acid;hydrate;dihydrochloride
InChI:
InChI=1S/C9H12N2O2.2ClH.H2O/c1-11(7-9(12)13)6-8-4-2-3-5-10-8;;;/h2-5H,6-7H2,1H3,(H,12,13);2*1H;1H2
InChI Key:
PQFYZCDUBRNSSY-UHFFFAOYSA-N
SMILES:
CN(Cc1ccccn1)CC(=O)O.O.Cl.Cl
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.054g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
271.138g/mol
Monoisotopic Mass:
270.054g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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