Name: Name:4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanone
Brand: Angene
SKU: AG003ALA
Rating: 90 (10 reviews)

4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanone

CAS No.:

17283-81-7

Catalog Number:

AG003ALA

Molecular Formula:

C13H22O

Molecular Weight:

194.3132

Catalog Number:

AG003ALA

Chemical Name:

4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanone

CAS Number:

17283-81-7

Molecular Formula:

C13H22O

Molecular Weight:

194.3132

MDL Number:

MFCD00456730

IUPAC Name:

4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-one

InChI:

InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3

InChI Key:

QJJDNZGPQDGNDX-UHFFFAOYSA-N

SMILES:

CC(=O)CCC1=C(C)CCCC1(C)C

EC Number:

241-318-1

UNII:

710YK6CESE

FEMA Number:

3626

Complexity:

258

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.167g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.318g/mol

Monoisotopic Mass:

194.167g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7