Home Other Building Blocks 3-methyl-1-(oxan-4-yl)-1H-pyrazole

3-methyl-1-(oxan-4-yl)-1H-pyrazole

CAS No.:
1339709-68-0
Catalog Number:
AG01DV9X
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
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Product Description
Catalog Number:
AG01DV9X
Chemical Name:
3-methyl-1-(oxan-4-yl)-1H-pyrazole
CAS Number:
1339709-68-0
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
MDL Number:
MFCD20329529
IUPAC Name:
3-methyl-1-(oxan-4-yl)pyrazole
InChI:
InChI=1S/C9H14N2O/c1-8-2-5-11(10-8)9-3-6-12-7-4-9/h2,5,9H,3-4,6-7H2,1H3
InChI Key:
PCXQLYQQERDIAY-UHFFFAOYSA-N
SMILES:
Cc1ccn(n1)C1CCOCC1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.111g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.224g/mol
Monoisotopic Mass:
166.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties