Research chemical
CAS Number: 101493-88-3
Product details
For laboratory research and professional procurement workflows.
PubChem CID
13619447
Exact Mass
288.245316
InChIKey
LAYJKDXVCRNLGE-UHFFFAOYSA-N
SMILES String
CCCCCCCCCCCC(=O)c1cc(C)ccc1C
No physical property values available.
XLogP
7.5
Catalog navigation
Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.
1-(2,5-Dimethylphenyl)dodecan-1-one is identified by CAS 101493-88-3, with molecular formula C20H32O, molecular weight 288.5, InChIKey LAYJKDXVCRNLGE-UHFFFAOYSA-N.
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Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
21
H-bond acceptors
1
H-bond donors
0
Rotatable bonds
11
Ring count
1
Aromatic rings
1
Topological polar surface area
17.07 Ų
Computed LogP
6.41
Fragment-like structure rule
Yes
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
other structure rule
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
1-(2,5-Dimethylphenyl)dodecan-1-one (CAS 101493-88-3) is an English MolGraph catalog reference, molecular formula C20H32O and molecular weight 288. 50 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page to review identity data, application tags, sourcing readiness, and RFQ context for catalysis and ligand research, research chemical sourcing.
Documentation needs
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Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.