Research chemical
CAS Number: 100944-14-7
![2,5-Diazabicyclo[2.2.1]heptane dihydrobromide molecular structure, CAS 100944-14-7](/structure-images/100944-14-7.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
16213147
Exact Mass
259.93467
InChIKey
ISYQWKOXKGJREA-UHFFFAOYSA-N
IUPAC Name
2,5-diazabicyclo[2.2.1]heptane;dihydrobromide
SMILES String
C1[NH2+]C2C[NH2+]C1C2.[Br-].[Br-]
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
2,5-Diazabicyclo[2.2.1]heptane dihydrobromide is identified by CAS 100944-14-7, with molecular formula C5H12Br2N2, molecular weight 259.97, InChIKey ISYQWKOXKGJREA-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
9
H-bond acceptors
2
H-bond donors
4
Rotatable bonds
0
Ring count
2
Aromatic rings
0
Topological polar surface area
33.22 Ų
Computed LogP
-8.72
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
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
2,5-Diazabicyclo[2. 2. 1]heptane dihydrobromide (CAS 100944-14-7) is listed in the Advanced Chemicals portfolio, with molecular formula C5H12Br2N2 and molecular weight 259. 97 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
Consult the supplier SDS 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.