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107934-60-1 molecular structure
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4-[9-(4-amino-3-methylphenyl)-9H-fluoren-9-yl]-2-methylaniline

ChemBase ID: 797046
Molecular Formular: C27H24N2
Molecular Mass: 376.49286
Monoisotopic Mass: 376.19394878
SMILES and InChIs

SMILES:
C1(c2ccccc2c2ccccc12)(c1cc(c(N)cc1)C)c1cc(c(N)cc1)C
Canonical SMILES:
Cc1cc(ccc1N)C1(c2ccc(c(c2)C)N)c2ccccc2c2c1cccc2
InChI:
InChI=1S/C27H24N2/c1-17-15-19(11-13-25(17)28)27(20-12-14-26(29)18(2)16-20)23-9-5-3-7-21(23)22-8-4-6-10-24(22)27/h3-16H,28-29H2,1-2H3
InChIKey:
YRKVLGUIGNRYJX-UHFFFAOYSA-N

Cite this record

CBID:797046 http://www.chembase.cn/molecule-797046.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-[9-(4-amino-3-methylphenyl)-9H-fluoren-9-yl]-2-methylaniline
IUPAC Traditional name
4-[9-(4-amino-3-methylphenyl)fluoren-9-yl]-2-methylaniline
Synonyms
4,4'-(9H-Fluorene-9,9-diyl)bis(2-Methylaniline)
CAS Number
107934-60-1

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O5519 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
LogD (pH = 5.5) 5.937879  LogD (pH = 7.4) 5.962366 
Log P 5.9626846  Molar Refractivity 123.5703 cm3
Polarizability 47.49534 Å3 Polar Surface Area 52.04 Å2
Rotatable Bonds Lipinski's Rule of Five false 
H Acceptors H Donor

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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