200,000+ products from a single source!
sales@angenechem.com
86296-18-6 | Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester
CAS No: 86296-18-6 Catalog No: AG004JGN MDL No:
Product Description
Catalog Number:
AG004JGN
Chemical Name:
Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester
CAS Number:
86296-18-6
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
IUPAC Name:
methyl 2-acetyl-5-oxocyclopentane-1-carboxylate
InChI:
InChI=1S/C9H12O4/c1-5(10)6-3-4-7(11)8(6)9(12)13-2/h6,8H,3-4H2,1-2H3
InChI Key:
BFLLIBBCGVMZMN-UHFFFAOYSA-N
SMILES:
COC(=O)C1C(=O)CCC1C(=O)C
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.191g/mol
Monoisotopic Mass:
184.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.