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Home > Pyridines > 1390654-31-5
1390654-31-5 | N-methyl-N-(4-pyridinylmethyl)glycine dihydrochloride
CAS No: 1390654-31-5 Catalog No: AG00J10K MDL No:MFCD13193825
Product Description
Catalog Number:
AG00J10K
Chemical Name:
N-methyl-N-(4-pyridinylmethyl)glycine dihydrochloride
CAS Number:
1390654-31-5
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
MDL Number:
MFCD13193825
IUPAC Name:
2-[methyl(pyridin-4-ylmethyl)amino]acetic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O2.2ClH/c1-11(7-9(12)13)6-8-2-4-10-5-3-8;;/h2-5H,6-7H2,1H3,(H,12,13);2*1H
InChI Key:
WAIHBBOIVUONIO-UHFFFAOYSA-N
SMILES:
CN(Cc1ccncc1)CC(=O)O.Cl.Cl
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.043g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
253.123g/mol
Monoisotopic Mass:
252.043g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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