Home Other Building Blocks [5-(oxolan-2-yl)-4H-1,2,4-triazol-3-yl]methanamine hydrochloride

[5-(oxolan-2-yl)-4H-1,2,4-triazol-3-yl]methanamine hydrochloride

CAS No.:
1909312-94-2
Catalog Number:
AG01B2D4
Molecular Formula:
C7H13ClN4O
Molecular Weight:
204.6573
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Product Description
Catalog Number:
AG01B2D4
Chemical Name:
[5-(oxolan-2-yl)-4H-1,2,4-triazol-3-yl]methanamine hydrochloride
CAS Number:
1909312-94-2
Molecular Formula:
C7H13ClN4O
Molecular Weight:
204.6573
MDL Number:
MFCD29907393
IUPAC Name:
[3-(oxolan-2-yl)-1H-1,2,4-triazol-5-yl]methanamine;hydrochloride
InChI:
InChI=1S/C7H12N4O.ClH/c8-4-6-9-7(11-10-6)5-2-1-3-12-5;/h5H,1-4,8H2,(H,9,10,11);1H
InChI Key:
FCPSDGVCKPJAAT-UHFFFAOYSA-N
SMILES:
NCc1nnc([nH]1)C1CCCO1.Cl
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.078g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
204.658g/mol
Monoisotopic Mass:
204.078g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties