Home Aminos 2-amino-2-(4-methyl-4H-1,2,4-triazol-3-yl)ethan-1-ol dihydrochloride

2-amino-2-(4-methyl-4H-1,2,4-triazol-3-yl)ethan-1-ol dihydrochloride

CAS No.:
1989671-86-4
Catalog Number:
AG01B6X1
Molecular Formula:
C5H12Cl2N4O
Molecular Weight:
215.0810
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Product Description
Catalog Number:
AG01B6X1
Chemical Name:
2-amino-2-(4-methyl-4H-1,2,4-triazol-3-yl)ethan-1-ol dihydrochloride
CAS Number:
1989671-86-4
Molecular Formula:
C5H12Cl2N4O
Molecular Weight:
215.0810
MDL Number:
MFCD30342966
IUPAC Name:
2-amino-2-(4-methyl-1,2,4-triazol-3-yl)ethanol;dihydrochloride
InChI:
InChI=1S/C5H10N4O.2ClH/c1-9-3-7-8-5(9)4(6)2-10;;/h3-4,10H,2,6H2,1H3;2*1H
InChI Key:
DGASLTKIUHBZHX-UHFFFAOYSA-N
SMILES:
OCC(c1nncn1C)N.Cl.Cl
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.039g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
215.078g/mol
Monoisotopic Mass:
214.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties