Research chemical
CAS Number: 4253-76-3
Product details
For laboratory research and professional procurement workflows.
PubChem CID
77931
Exact Mass
326.366099
InChIKey
DXYUWQFEDOQSQY-UHFFFAOYSA-N
IUPAC Name
N'-octadecylpropane-1,3-diamine
SMILES String
CCCCCCCCCCCCCCCCCCNCCCN
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.
N1-Octadecyl-1,3-propanediamine is identified by CAS 4253-76-3, with molecular formula C21H46N2, molecular weight 326.6, InChIKey DXYUWQFEDOQSQY-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
23
H-bond acceptors
2
H-bond donors
3
Rotatable bonds
20
Ring count
0
Aromatic rings
0
Topological polar surface area
38.05 Ų
Computed LogP
6.19
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
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
N1-Octadecyl-1,3-propanediamine (CAS 4253-76-3) is maintained as a commercial cas reference with formula C21H46N2, molecular weight 326. 60 g/mol, PubChem CID 77931.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.