Home Other Building Blocks 3-(1-methyl-1H-pyrazol-5-yl)cyclopentan-1-one

3-(1-methyl-1H-pyrazol-5-yl)cyclopentan-1-one

CAS No.:
1340410-90-3
Catalog Number:
AG01B2GN
Molecular Formula:
C9H12N2O
Molecular Weight:
164.2044
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Product Description
Catalog Number:
AG01B2GN
Chemical Name:
3-(1-methyl-1H-pyrazol-5-yl)cyclopentan-1-one
CAS Number:
1340410-90-3
Molecular Formula:
C9H12N2O
Molecular Weight:
164.2044
MDL Number:
MFCD20336689
IUPAC Name:
3-(2-methylpyrazol-3-yl)cyclopentan-1-one
InChI:
InChI=1S/C9H12N2O/c1-11-9(4-5-10-11)7-2-3-8(12)6-7/h4-5,7H,2-3,6H2,1H3
InChI Key:
CHLJFPQWWZRSPD-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)c1ccnn1C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.095g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.208g/mol
Monoisotopic Mass:
164.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties