Home Other Building Blocks 3-(benzyloxy)-1H-pyrazole

3-(benzyloxy)-1H-pyrazole

CAS No.:
852471-13-7
Catalog Number:
AG01C13G
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
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Product Description
Catalog Number:
AG01C13G
Chemical Name:
3-(benzyloxy)-1H-pyrazole
CAS Number:
852471-13-7
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
MDL Number:
MFCD29054864
IUPAC Name:
5-phenylmethoxy-1H-pyrazole
InChI:
InChI=1S/C10H10N2O/c1-2-4-9(5-3-1)8-13-10-6-7-11-12-10/h1-7H,8H2,(H,11,12)
InChI Key:
LWXHLNHAYCDUGT-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)COc1n[nH]cc1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.203g/mol
Monoisotopic Mass:
174.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties