Home Other Building Blocks 5H,6H,7H,8H,9H-[1,2,3,4]tetrazolo[1,5-a]azepin-7-amine hydrochloride

5H,6H,7H,8H,9H-[1,2,3,4]tetrazolo[1,5-a]azepin-7-amine hydrochloride

CAS No.:
1909325-69-4
Catalog Number:
AG01C3T9
Molecular Formula:
C6H12ClN5
Molecular Weight:
189.6460
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Product Description
Catalog Number:
AG01C3T9
Chemical Name:
5H,6H,7H,8H,9H-[1,2,3,4]tetrazolo[1,5-a]azepin-7-amine hydrochloride
CAS Number:
1909325-69-4
Molecular Formula:
C6H12ClN5
Molecular Weight:
189.6460
MDL Number:
MFCD29762873
IUPAC Name:
6,7,8,9-tetrahydro-5H-tetrazolo[1,5-a]azepin-7-amine;hydrochloride
InChI:
InChI=1S/C6H11N5.ClH/c7-5-1-2-6-8-9-10-11(6)4-3-5;/h5H,1-4,7H2;1H
InChI Key:
YNHWMEJDDKLCFK-UHFFFAOYSA-N
SMILES:
NC1CCn2c(CC1)nnn2.Cl
Properties
Complexity:
139  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.078g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
189.647g/mol
Monoisotopic Mass:
189.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties