Home Other Building Blocks 3-{[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}propan-1-ol

3-{[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}propan-1-ol

CAS No.:
1394042-36-4
Catalog Number:
AG019SQT
Molecular Formula:
C8H10N4O
Molecular Weight:
178.1912
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Product Description
Catalog Number:
AG019SQT
Chemical Name:
3-{[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}propan-1-ol
CAS Number:
1394042-36-4
Molecular Formula:
C8H10N4O
Molecular Weight:
178.1912
MDL Number:
MFCD22375439
IUPAC Name:
3-([1,2,4]triazolo[1,5-a]pyrimidin-2-yl)propan-1-ol
InChI:
InChI=1S/C8H10N4O/c13-6-1-3-7-10-8-9-4-2-5-12(8)11-7/h2,4-5,13H,1,3,6H2
InChI Key:
CTSKBQFIHHTYQI-UHFFFAOYSA-N
SMILES:
OCCCc1nn2c(n1)nccc2
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.195g/mol
Monoisotopic Mass:
178.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties