Home Other Building Blocks 2-(2-methyl-3-oxocyclopentyl)acetic acid

2-(2-methyl-3-oxocyclopentyl)acetic acid

CAS No.:
57026-65-0
Catalog Number:
AG01BGIG
Molecular Formula:
C8H12O3
Molecular Weight:
156.1791
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Product Description
Catalog Number:
AG01BGIG
Chemical Name:
2-(2-methyl-3-oxocyclopentyl)acetic acid
CAS Number:
57026-65-0
Molecular Formula:
C8H12O3
Molecular Weight:
156.1791
MDL Number:
MFCD20651528
IUPAC Name:
2-(2-methyl-3-oxocyclopentyl)acetic acid
InChI:
InChI=1S/C8H12O3/c1-5-6(4-8(10)11)2-3-7(5)9/h5-6H,2-4H2,1H3,(H,10,11)
InChI Key:
VNXRDGISGJJAAW-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCC(=O)C1C
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.079g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.181g/mol
Monoisotopic Mass:
156.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties