Home Other Building Blocks 2-hydrazinyl-3a,4,5,6,7,7a-hexahydro-1H-1,3-benzodiazole hydrobromide

2-hydrazinyl-3a,4,5,6,7,7a-hexahydro-1H-1,3-benzodiazole hydrobromide

CAS No.:
99347-22-5
Catalog Number:
AG01A2H4
Molecular Formula:
C7H15BrN4
Molecular Weight:
235.1248
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Product Description
Catalog Number:
AG01A2H4
Chemical Name:
2-hydrazinyl-3a,4,5,6,7,7a-hexahydro-1H-1,3-benzodiazole hydrobromide
CAS Number:
99347-22-5
Molecular Formula:
C7H15BrN4
Molecular Weight:
235.1248
MDL Number:
MFCD22578580
IUPAC Name:
3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylhydrazine;hydrobromide
InChI:
InChI=1S/C7H14N4.BrH/c8-11-7-9-5-3-1-2-4-6(5)10-7;/h5-6H,1-4,8H2,(H2,9,10,11);1H
InChI Key:
BYJGPKZXKZJIQS-UHFFFAOYSA-N
SMILES:
NNC1=NC2C(N1)CCCC2.Br
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
235.129g/mol
Monoisotopic Mass:
234.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties