Name: Name:5-(4-Isopropylphenyl)cyclohexane-1,3-dione
Brand: Angene
SKU: AG00BJYZ
Rating: 90 (10 reviews)

5-(4-Isopropylphenyl)cyclohexane-1,3-dione

CAS No.:

27463-47-4

Catalog Number:

AG00BJYZ

Molecular Formula:

C15H18O2

Molecular Weight:

230.3022

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

250mg

95%

1 week

United States

$838

- +

Product Description

Catalog Number:

AG00BJYZ

Chemical Name:

5-(4-Isopropylphenyl)cyclohexane-1,3-dione

CAS Number:

27463-47-4

Molecular Formula:

C15H18O2

Molecular Weight:

230.3022

MDL Number:

MFCD08753426

IUPAC Name:

5-(4-propan-2-ylphenyl)cyclohexane-1,3-dione

InChI:

InChI=1S/C15H18O2/c1-10(2)11-3-5-12(6-4-11)13-7-14(16)9-15(17)8-13/h3-6,10,13H,7-9H2,1-2H3

InChI Key:

GZEOADDHUHXTCJ-UHFFFAOYSA-N

SMILES:

CC(c1ccc(cc1)C1CC(=O)CC(=O)C1)C

Properties

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.307g/mol

Monoisotopic Mass:

230.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
Cyclohexane 1,3-diones and their inhibition of mutant SOD1-dependent protein aggregation and toxicity in PC12 cells.	Bioorganic & medicinal chemistry 20120115