Home Other Building Blocks 3,5-dicyclopropyl-1H-1,2,4-triazole hydrochloride

3,5-dicyclopropyl-1H-1,2,4-triazole hydrochloride

CAS No.:
1423033-56-0
Catalog Number:
AG01A19F
Molecular Formula:
C8H12ClN3
Molecular Weight:
185.6540
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Product Description
Catalog Number:
AG01A19F
Chemical Name:
3,5-dicyclopropyl-1H-1,2,4-triazole hydrochloride
CAS Number:
1423033-56-0
Molecular Formula:
C8H12ClN3
Molecular Weight:
185.6540
MDL Number:
MFCD22421784
IUPAC Name:
3,5-dicyclopropyl-1H-1,2,4-triazole;hydrochloride
InChI:
InChI=1S/C8H11N3.ClH/c1-2-5(1)7-9-8(11-10-7)6-3-4-6;/h5-6H,1-4H2,(H,9,10,11);1H
InChI Key:
NXVACEAPEPDFHT-UHFFFAOYSA-N
SMILES:
n1[nH]c(nc1C1CC1)C1CC1.Cl
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.072g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
185.655g/mol
Monoisotopic Mass:
185.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties