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(2,2-dimethyl-4-naphthalen-1-yl-3,3a-dihydro-1H-perimidin-4-yl)-phenyldiazenyldiazene

HCID 3045254
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Basic information

CAS
65322-64-7
Standard SMILES
CC1(C)Nc2cccc3c2C(N1)C(N=NN=Nc1ccccc1)(c1cccc2ccccc12)C=C3
InChIKey
GKZXVIDZGVPNII-UHFFFAOYSA-N
Molecular formula
C29H26N6
Average molar mass
458.6 g/mol
Monoisotopic mass
458.22189485

Names & identifiers

Preferred name
(2,2-dimethyl-4-naphthalen-1-yl-3,3a-dihydro-1H-perimidin-4-yl)-phenyldiazenyldiazene
IUPAC
(2,2-dimethyl-4-naphthalen-1-yl-3,3a-dihydro-1H-perimidin-4-yl)-phenyldiazenyldiazene

Names & synonyms

EINECS 265-698-3(2,2-dimethyl-4-naphthalen-1-yl-3,3a-dihydro-1H-perimidin-4-yl)-phenyldiazenyldiazeneNS001216412,3-Dihydro-2,2-dimethyl-4-((1-naphthyl-4-(phenylazo))azo)-1H-perimidine

Database identifiers

CAS
65322-64-7
PubChem CID
3045254

Properties

Computed structural properties

XLogP
7.4
Topological polar surface area
73.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
35
Formal charge
0
Complexity
829

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