methyl 6-oxohexanoate

methyl 6-oxohexanoate

CAS: 6654-36-0

Formula: C7H12O3

SMILES: COC(=O)CCCCC=O

IUPAC: methyl 6-oxohexanoate

InChI: InChI=1S/C7H12O3/c1-10-7(9)5-3-2-4-6-8/h6H,2-5H2,1H3

Composition: C (58.32%), H (8.39%), O (33.29%)

Molar Mass: 144.17

Atom Count: 22

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	144.078644246
Formal Charge	0
FSP3	0.71
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FDNFXHCDOASWAY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.58
Topological Polar Surface Area	43.37
Polarizability	14.5
Ring Count	0
Rotatable Bond Count	6

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Kinentia Biosciences LLC

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