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2409-19-0 molecular structure
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3-[9-(3-aminopropyl)-9H-fluoren-9-yl]propan-1-amine

ChemBase ID: 108434
Molecular Formular: C19H24N2
Molecular Mass: 280.40726
Monoisotopic Mass: 280.19394878
SMILES and InChIs

SMILES:
NCCCC1(CCCN)c2ccccc2c2ccccc12
Canonical SMILES:
NCCCC1(CCCN)c2ccccc2c2c1cccc2
InChI:
InChI=1S/C19H24N2/c20-13-5-11-19(12-6-14-21)17-9-3-1-7-15(17)16-8-2-4-10-18(16)19/h1-4,7-10H,5-6,11-14,20-21H2
InChIKey:
YREZIWUCYDRMPK-UHFFFAOYSA-N

Cite this record

CBID:108434 http://www.chembase.cn/molecule-108434.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
3-[9-(3-aminopropyl)-9H-fluoren-9-yl]propan-1-amine
IUPAC Traditional name
fluorene-9,9-(bis)propylamine
Synonyms
9,9-bis(3-AMINOPROPYL)FLUORENE
CAS Number
2409-19-0
PubChem SID
162095635
PubChem CID
17001

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05207331 external link Add to cart Please log in.
Data Source Data ID
PubChem 17001 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.0306828  LogD (pH = 7.4) -2.189549 
Log P 3.0172393  Molar Refractivity 99.9679 cm3
Polarizability 36.597775 Å3 Polar Surface Area 52.04 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05207331 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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