Home Other Building Blocks 2-(1,2,4-oxadiazol-3-yl)azepane hydrochloride

2-(1,2,4-oxadiazol-3-yl)azepane hydrochloride

CAS No.:
1461709-00-1
Catalog Number:
AG01A6OT
Molecular Formula:
C8H14ClN3O
Molecular Weight:
203.6693
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Product Description
Catalog Number:
AG01A6OT
Chemical Name:
2-(1,2,4-oxadiazol-3-yl)azepane hydrochloride
CAS Number:
1461709-00-1
Molecular Formula:
C8H14ClN3O
Molecular Weight:
203.6693
MDL Number:
MFCD25970379
IUPAC Name:
3-(azepan-2-yl)-1,2,4-oxadiazole;hydrochloride
InChI:
InChI=1S/C8H13N3O.ClH/c1-2-4-7(9-5-3-1)8-10-6-12-11-8;/h6-7,9H,1-5H2;1H
InChI Key:
WIPSHHBMHWZJQN-UHFFFAOYSA-N
SMILES:
C1CCNC(CC1)c1ncon1.Cl
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.083g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.67g/mol
Monoisotopic Mass:
203.083g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties