Home Other Building Blocks bis[2-(1H-1,2,4-triazol-1-yl)ethyl]amine

bis[2-(1H-1,2,4-triazol-1-yl)ethyl]amine

CAS No.:
1258651-27-2
Catalog Number:
AG01AAR4
Molecular Formula:
C8H13N7
Molecular Weight:
207.2357
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Product Description
Catalog Number:
AG01AAR4
Chemical Name:
bis[2-(1H-1,2,4-triazol-1-yl)ethyl]amine
CAS Number:
1258651-27-2
Molecular Formula:
C8H13N7
Molecular Weight:
207.2357
MDL Number:
MFCD17480394
IUPAC Name:
2-(1,2,4-triazol-1-yl)-N-[2-(1,2,4-triazol-1-yl)ethyl]ethanamine
InChI:
InChI=1S/C8H13N7/c1(3-14-7-10-5-12-14)9-2-4-15-8-11-6-13-15/h5-9H,1-4H2
InChI Key:
OHXUXLWPMWKQEK-UHFFFAOYSA-N
SMILES:
N(CCn1ncnc1)CCn1ncnc1
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.123g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.241g/mol
Monoisotopic Mass:
207.123g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties