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

[1-(propan-2-yl)-1H-1,2,3-triazol-4-yl]methanol

CAS No.:
1249227-50-6
Catalog Number:
AG01B9Q8
Molecular Formula:
C6H11N3O
Molecular Weight:
141.1710
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Product Description
Catalog Number:
AG01B9Q8
Chemical Name:
[1-(propan-2-yl)-1H-1,2,3-triazol-4-yl]methanol
CAS Number:
1249227-50-6
Molecular Formula:
C6H11N3O
Molecular Weight:
141.1710
MDL Number:
MFCD16747760
IUPAC Name:
(1-propan-2-yltriazol-4-yl)methanol
InChI:
InChI=1S/C6H11N3O/c1-5(2)9-3-6(4-10)7-8-9/h3,5,10H,4H2,1-2H3
InChI Key:
VWUSXTIUSAVEAQ-UHFFFAOYSA-N
SMILES:
OCc1nnn(c1)C(C)C
Properties
Complexity:
107  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.09g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.174g/mol
Monoisotopic Mass:
141.09g/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