Home Other Building Blocks 6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine hydrochloride

6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine hydrochloride

CAS No.:
1956322-33-0
Catalog Number:
AG019EMD
Molecular Formula:
C6H11ClN4
Molecular Weight:
174.6313
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Product Description
Catalog Number:
AG019EMD
Chemical Name:
6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine hydrochloride
CAS Number:
1956322-33-0
Molecular Formula:
C6H11ClN4
Molecular Weight:
174.6313
MDL Number:
MFCD28399355
IUPAC Name:
6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine;hydrochloride
InChI:
InChI=1S/C6H10N4.ClH/c1-2-7-3-4-10-5-8-9-6(1)10;/h5,7H,1-4H2;1H
InChI Key:
FXSPBWVSCDJJOX-UHFFFAOYSA-N
SMILES:
N1CCn2c(CC1)nnc2.Cl
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.067g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
174.632g/mol
Monoisotopic Mass:
174.067g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties