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

(5-cyclobutyl-4-methyl-4H-1,2,4-triazol-3-yl)methanol

CAS No.:
1443981-35-8
Catalog Number:
AG01A5JV
Molecular Formula:
C8H13N3O
Molecular Weight:
167.2083
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Product Description
Catalog Number:
AG01A5JV
Chemical Name:
(5-cyclobutyl-4-methyl-4H-1,2,4-triazol-3-yl)methanol
CAS Number:
1443981-35-8
Molecular Formula:
C8H13N3O
Molecular Weight:
167.2083
MDL Number:
MFCD24197716
IUPAC Name:
(5-cyclobutyl-4-methyl-1,2,4-triazol-3-yl)methanol
InChI:
InChI=1S/C8H13N3O/c1-11-7(5-12)9-10-8(11)6-3-2-4-6/h6,12H,2-5H2,1H3
InChI Key:
QCNUFJQHEPOZQT-UHFFFAOYSA-N
SMILES:
OCc1nnc(n1C)C1CCC1
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.106g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.212g/mol
Monoisotopic Mass:
167.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties