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N,N'-bis(4,6-dimethylpyrimidin-2-yl)hexane-1,6-diamine

HCID 331091
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Basic information

CAS
92736-23-7
Standard SMILES
Cc1cc(C)nc(NCCCCCCNc2nc(C)cc(C)n2)n1
InChIKey
GJWJWSOXJDHKHZ-UHFFFAOYSA-N
Molecular formula
C18H28N6
Average molar mass
328.5 g/mol
Monoisotopic mass
328.23754492

Names & identifiers

Preferred name
N,N'-bis(4,6-dimethylpyrimidin-2-yl)hexane-1,6-diamine
IUPAC
N,N'-bis(4,6-dimethylpyrimidin-2-yl)hexane-1,6-diamine

Names & synonyms

NSC321212NSC-321212

Database identifiers

CAS
92736-23-7
PubChem CID
331091

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
75.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
24
Formal charge
0
Complexity
287

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Compound notes

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