Home Other Building Blocks 2-(1-methyl-1H-1,2,3-triazol-5-yl)ethan-1-ol

2-(1-methyl-1H-1,2,3-triazol-5-yl)ethan-1-ol

CAS No.:
1594471-58-5
Catalog Number:
AG01BHY5
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
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Product Description
Catalog Number:
AG01BHY5
Chemical Name:
2-(1-methyl-1H-1,2,3-triazol-5-yl)ethan-1-ol
CAS Number:
1594471-58-5
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
MDL Number:
MFCD30734018
IUPAC Name:
2-(3-methyltriazol-4-yl)ethanol
InChI:
InChI=1S/C5H9N3O/c1-8-5(2-3-9)4-6-7-8/h4,9H,2-3H2,1H3
InChI Key:
LFRCHXXTPDBTLI-UHFFFAOYSA-N
SMILES:
OCCc1cnnn1C
Properties
Complexity:
88.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.075g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.147g/mol
Monoisotopic Mass:
127.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties