Home Other Building Blocks 2-(3-methyl-4H-1,2,4-triazol-4-yl)ethan-1-amine dihydrochloride

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

CAS No.:
1334147-24-8
Catalog Number:
AG01AJPB
Molecular Formula:
C5H12Cl2N4
Molecular Weight:
199.0816
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Product Description
Catalog Number:
AG01AJPB
Chemical Name:
2-(3-methyl-4H-1,2,4-triazol-4-yl)ethan-1-amine dihydrochloride
CAS Number:
1334147-24-8
Molecular Formula:
C5H12Cl2N4
Molecular Weight:
199.0816
MDL Number:
MFCD19686313
IUPAC Name:
2-(3-methyl-1,2,4-triazol-4-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C5H10N4.2ClH/c1-5-8-7-4-9(5)3-2-6;;/h4H,2-3,6H2,1H3;2*1H
InChI Key:
VQQNBDRIUHIATK-UHFFFAOYSA-N
SMILES:
NCCn1cnnc1C.Cl.Cl
Properties
Complexity:
85  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.044g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
199.079g/mol
Monoisotopic Mass:
198.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties