Research chemical
CAS Number: 53067-27-9
![Propanenitrile, 3,3'-[[2-[(2-cyanoethoxy)methyl]-2-ethyl-1,3-propanediyl]bis(oxy)]bis- molecular structure, CAS 53067-27-9](/structure-images/53067-27-9.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
104402
Exact Mass
293.173942
InChIKey
MVIGWYTVWUNJIO-UHFFFAOYSA-N
IUPAC Name
3-[2,2-bis(2-cyanoethoxymethyl)butoxy]propanenitrile
SMILES String
CCC(COCCC#N)(COCCC#N)COCCC#N
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.
Propanenitrile, 3,3'-[[2-[(2-cyanoethoxy)methyl]-2-ethyl-1,3-propanediyl]bis(oxy)]bis- is identified by CAS 53067-27-9, with molecular formula C15H23N3O3, molecular weight 293.36, InChIKey MVIGWYTVWUNJIO-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
21
H-bond acceptors
6
H-bond donors
0
Rotatable bonds
13
Ring count
0
Aromatic rings
0
Topological polar surface area
99.06 Ų
Computed LogP
2.17
Fragment-like structure rule
Yes
Lead-like structure rule
Yes
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
Propanenitrile, 3,3'-[[2-[(2-cyanoethoxy)methyl]-2-ethyl-1,3-propanediyl]bis(oxy)]bis- (CAS 53067-27-9) is maintained as a commercial cas reference with formula C15H23N3O3, molecular weight 293. 36 g/mol, PubChem CID 104402.
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; structure-derived tags include fragment-like structure profile, lead-like structure profile, drug-like rule profile.
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.