Home Other Building Blocks [5-(difluoromethyl)-1-methyl-1H-1,2,3-triazol-4-yl]methanol

[5-(difluoromethyl)-1-methyl-1H-1,2,3-triazol-4-yl]methanol

CAS No.:
2138075-65-5
Catalog Number:
AG01EMQ9
Molecular Formula:
C5H7F2N3O
Molecular Weight:
163.1254
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Product Description
Catalog Number:
AG01EMQ9
Chemical Name:
[5-(difluoromethyl)-1-methyl-1H-1,2,3-triazol-4-yl]methanol
CAS Number:
2138075-65-5
Molecular Formula:
C5H7F2N3O
Molecular Weight:
163.1254
MDL Number:
MFCD31559013
IUPAC Name:
[5-(difluoromethyl)-1-methyltriazol-4-yl]methanol
InChI:
InChI=1S/C5H7F2N3O/c1-10-4(5(6)7)3(2-11)8-9-10/h5,11H,2H2,1H3
InChI Key:
ZWSWDALCSUKOIS-UHFFFAOYSA-N
SMILES:
OCc1nnn(c1C(F)F)C
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.128g/mol
Monoisotopic Mass:
163.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties