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3407-93-0 molecular structure
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9-hydrazinylacridine

ChemBase ID: 91411
Molecular Formular: C13H11N3
Molecular Mass: 209.24654
Monoisotopic Mass: 209.09529737
SMILES and InChIs

SMILES:
n1c2c(c(c3ccccc13)NN)cccc2
Canonical SMILES:
NNc1c2ccccc2nc2c1cccc2
InChI:
InChI=1S/C13H11N3/c14-16-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,14H2,(H,15,16)
InChIKey:
SVANEUDZNISLJD-UHFFFAOYSA-N

Cite this record

CBID:91411 http://www.chembase.cn/molecule-91411.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
9-hydrazinylacridine
IUPAC Traditional name
acridine, 9-hydrazino-
Synonyms
9-Hydrazinoacridine
p-HYDRAZINOACRIDINE
CAS Number
3407-93-0
MDL Number
MFCD00051330
PubChem SID
162078110
PubChem CID
18864

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 18864 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.2518685  LogD (pH = 7.4) 2.1843195 
Log P 2.89787  Molar Refractivity 65.7642 cm3
Polarizability 27.199253 Å3 Polar Surface Area 50.94 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
Storage Warning
Irritant expand Show data source
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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