Research chemical
CAS Number: 40537-72-2
![Anthra[9,1,2-cde]benzo[rst]pentaphene, trichloro-5,10-diethoxy- molecular structure, CAS 40537-72-2](/structure-images/40537-72-2.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
170387
Exact Mass
616.076363
InChIKey
ZKTIYNAZFIWRSM-UHFFFAOYSA-N
IUPAC Name
15,29,30-trichloro-12,21-diethoxynonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(31),2,4,6,8,10,12,14,16,18,20,22,24,26,28(32),29,33-heptadecaene
SMILES String
CCOC1=C2C=CC3=C4C(=CC5=C(C6=CC=CC=C6C7=C5C4=C(C=C7)C8=C3C2=C(C9=CC=CC=C91)C(=C8Cl)Cl)OCC)Cl
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.
Anthra[9,1,2-cde]benzo[rst]pentaphene, trichloro-5,10-diethoxy- is identified by CAS 40537-72-2, with molecular formula C38H23Cl3O2, molecular weight 617.9, InChIKey ZKTIYNAZFIWRSM-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.
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
43
H-bond acceptors
2
H-bond donors
0
Rotatable bonds
4
Ring count
9
Aromatic rings
9
Topological polar surface area
18.46 Ų
Computed LogP
12.55
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
other structure rule
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
Anthra[9,1,2-cde]benzo[rst]pentaphene, trichloro-5,10-diethoxy- (CAS 40537-72-2) is maintained as a commercial cas reference with formula C38H23Cl3O2, molecular weight 617. 90 g/mol, PubChem CID 170387.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
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Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
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