Research chemical
CAS Number: 10042-65-6
Product details
For laboratory research and professional procurement workflows.
PubChem CID
165799
Exact Mass
359.339944
InChIKey
TUSQGJPKLFNBCZ-UHFFFAOYSA-N
IUPAC Name
1-aminopropan-2-ol;octadecanoic acid
SMILES String
CCCCCCCCCCCCCCCCCC(=O)O.CC(CN)O
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
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.
Octadecanoic acid, compd. with 1-amino-2-propanol (1:1) is identified by CAS 10042-65-6, with molecular formula C21H45NO3, molecular weight 359.6, InChIKey TUSQGJPKLFNBCZ-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
25
H-bond acceptors
4
H-bond donors
4
Rotatable bonds
17
Ring count
0
Aromatic rings
0
Topological polar surface area
83.55 Ų
Computed LogP
5.66
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
organic nitrogen ligand candidate
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
Octadecanoic acid, compd. with 1-amino-2-propanol (1:1) (CAS 10042-65-6) is an English MolGraph catalog reference, molecular formula C21H45NO3 and molecular weight 359. 60 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
Request supplier-issued SDS/COA before handling, storage, shipment, or procurement decisions. Public page content is for research catalog reference and does not replace supplier-issued safety documentation.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.