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1820666-15-6 | "(1-(2-(methylamino)ethyl)-1H-1,2,3-triazol-4-yl)methanol hydrochloride"
CAS No: 1820666-15-6 Catalog No: AG01FM7U MDL No:MFCD29046746
Product Description
Catalog Number:
AG01FM7U
Chemical Name:
"(1-(2-(methylamino)ethyl)-1H-1,2,3-triazol-4-yl)methanol hydrochloride"
CAS Number:
1820666-15-6
Molecular Formula:
C6H14Cl2N4O
Molecular Weight:
229.1076
MDL Number:
MFCD29046746
IUPAC Name:
[1-[2-(methylamino)ethyl]triazol-4-yl]methanol;hydrochloride
InChI:
InChI=1S/C6H12N4O.ClH/c1-7-2-3-10-4-6(5-11)8-9-10;/h4,7,11H,2-3,5H2,1H3;1H
InChI Key:
MNKBASQRANINND-UHFFFAOYSA-N
SMILES:
OCc1nnn(c1)CCNC.Cl.Cl
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.078g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
192.647g/mol
Monoisotopic Mass:
192.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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