Chemical ID: 5578904

CC1=CC(=NNc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])C(=C(C)C)CC1
Chemical ID:
5578904
Name [?]:
N-[(6-isopropylidene-3-methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline
SMILES [?]:
CC1=CC(=NNc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])C(=C(C)C)CC1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H18N4O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:-0.448569
Area:531.098
Solvation:-13.726
Coulombic:-28.1656
Bond Count [?]
All:25
Single:17
Double:8
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:330.339
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:4.3
LogP (Chemaxon):5.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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