Name: Name:4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-one
Brand: Angene
SKU: AG01A4RD
Rating: 90 (10 reviews)

4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-one

CAS No.:

1339256-33-5

Catalog Number:

AG01A4RD

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

Catalog Number:

AG01A4RD

Chemical Name:

4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-one

CAS Number:

1339256-33-5

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

MDL Number:

MFCD18335263

IUPAC Name:

4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-one

InChI:

InChI=1S/C9H12N2O2/c1-6-10-9(13-11-6)7-2-4-8(12)5-3-7/h7H,2-5H2,1H3

InChI Key:

IKBWGTJNGDKJTL-UHFFFAOYSA-N

SMILES:

O=C1CCC(CC1)c1onc(n1)C

Complexity:

198

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.207g/mol

Monoisotopic Mass:

180.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

56A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8