Research chemical
CAS Number: 1031207-76-7
![1-Benzyl-4-[3-(1,1-difluoroethyl)-5-methyl-1,2,4-triazol-4-yl]piperidine molecular structure, CAS 1031207-76-7](/structure-images/1031207-76-7.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
Not available
Exact Mass
320.181253
InChIKey
UGLVVSCIHXKFBN-UHFFFAOYSA-N
SMILES String
Cc1nnc(C(C)(F)F)n1C1CCN(Cc2ccccc2)CC1
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.
1-Benzyl-4-[3-(1,1-difluoroethyl)-5-methyl-1,2,4-triazol-4-yl]piperidine is identified by CAS 1031207-76-7, with molecular formula C17H22F2N4, molecular weight 320.4, InChIKey UGLVVSCIHXKFBN-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.
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
23
H-bond acceptors
4
H-bond donors
0
Rotatable bonds
4
Ring count
3
Aromatic rings
2
Topological polar surface area
33.95 Ų
Computed LogP
3.54
Fragment-like structure rule
No
Lead-like structure rule
Yes
Drug-like structure rule
Yes
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
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-Benzyl-4-[3-(1,1-difluoroethyl)-5-methyl-1,2,4-triazol-4-yl]piperidine (CAS 1031207-76-7) is maintained as a cataloged research chemical with formula C17H22F2N4, molecular weight 320. 40 g/mol, PubChem CID 59287291.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for identity verification, supplier-aware sourcing review, and RFQ preparation; structure-derived tags include nitrogen-containing heterocycle, lead-like structure profile, drug-like rule profile.
Documentation needs
SDS signal word: Warning; hazard codes: H302, H315, H319, H335; for research use only.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS Request