Home Other Building Blocks 4-(1-methyl-1H-pyrazol-5-yl)oxan-4-ol

4-(1-methyl-1H-pyrazol-5-yl)oxan-4-ol

CAS No.:
1341353-18-1
Catalog Number:
AG01BUUL
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
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Product Description
Catalog Number:
AG01BUUL
Chemical Name:
4-(1-methyl-1H-pyrazol-5-yl)oxan-4-ol
CAS Number:
1341353-18-1
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
MDL Number:
MFCD19620485
IUPAC Name:
4-(2-methylpyrazol-3-yl)oxan-4-ol
InChI:
InChI=1S/C9H14N2O2/c1-11-8(2-5-10-11)9(12)3-6-13-7-4-9/h2,5,12H,3-4,6-7H2,1H3
InChI Key:
RRFZNMWQMSNCNE-UHFFFAOYSA-N
SMILES:
OC1(CCOCC1)c1ccnn1C
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.106g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.223g/mol
Monoisotopic Mass:
182.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties