Research chemical
CAS Number: 100826-95-7
![N6-[(6-Aminohexyl)carbamoylmethyl]-ADP molecular structure, CAS 100826-95-7](/structure-images/100826-95-7.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
171042937
Exact Mass
583.155679
InChIKey
MMSIXCSIWMOXLY-XKLVTHTNSA-N
IUPAC Name
[(2R,3S,4R,5R)-5-[6-[[2-(6-aminohexylamino)-2-oxoethyl]amino]purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
SMILES String
NCCCCCCNC(=O)CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
No physical property values available.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
N6-[(6-Aminohexyl)carbamoylmethyl]-ADP is identified by CAS 100826-95-7, with molecular formula C18H31N7O11P2, molecular weight 583.4, InChIKey MMSIXCSIWMOXLY-XKLVTHTNSA-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.
XLogP
-6.4
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
38
H-bond acceptors
18
H-bond donors
9
Rotatable bonds
15
Ring count
3
Aromatic rings
2
Topological polar surface area
273.73 Ų
Computed LogP
-1.28
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
phosphine ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
Yes
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
N6-[(6-Aminohexyl)carbamoylmethyl]-ADP (CAS 100826-95-7) is an English MolGraph catalog reference, molecular formula C18H31N7O11P2 and molecular weight 583. 40 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 heterocyclic building-block 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.