Home Other Building Blocks 3-(3,4-DIMETHOXYPHENYL)PYRAZOLE

3-(3,4-DIMETHOXYPHENYL)PYRAZOLE

CAS No.:
154257-70-2
Catalog Number:
AG00AP7J
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
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Product Description
Catalog Number:
AG00AP7J
Chemical Name:
3-(3,4-DIMETHOXYPHENYL)PYRAZOLE
CAS Number:
154257-70-2
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
MDL Number:
MFCD02091527
IUPAC Name:
5-(3,4-dimethoxyphenyl)-1H-pyrazole
InChI:
InChI=1S/C11H12N2O2/c1-14-10-4-3-8(7-11(10)15-2)9-5-6-12-13-9/h3-7H,1-2H3,(H,12,13)
InChI Key:
SKDIDNLXZGTGPW-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1n[nH]cc1
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties