Home Halogens [1-(2-chlorophenyl)-1H-1,2,3-triazol-5-yl]methanol

[1-(2-chlorophenyl)-1H-1,2,3-triazol-5-yl]methanol

CAS No.:
1429254-44-3
Catalog Number:
AG01BUVU
Molecular Formula:
C9H8ClN3O
Molecular Weight:
209.6323
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Product Description
Catalog Number:
AG01BUVU
Chemical Name:
[1-(2-chlorophenyl)-1H-1,2,3-triazol-5-yl]methanol
CAS Number:
1429254-44-3
Molecular Formula:
C9H8ClN3O
Molecular Weight:
209.6323
MDL Number:
MFCD24846864
IUPAC Name:
[3-(2-chlorophenyl)triazol-4-yl]methanol
InChI:
InChI=1S/C9H8ClN3O/c10-8-3-1-2-4-9(8)13-7(6-14)5-11-12-13/h1-5,14H,6H2
InChI Key:
GDKLVPBBSNXAGJ-UHFFFAOYSA-N
SMILES:
OCc1cnnn1c1ccccc1Cl
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.036g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.633g/mol
Monoisotopic Mass:
209.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties