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162219612 molecular structure
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2-chloro-9,10-diphenylanthracene

ChemBase ID: 125262
Molecular Formular: C26H17Cl
Molecular Mass: 364.86618
Monoisotopic Mass: 364.10187822
SMILES and InChIs

SMILES:
Clc1ccc2c(c3ccccc3c(c3ccccc3)c2c1)c1ccccc1
Canonical SMILES:
Clc1ccc2c(c1)c(c1ccccc1)c1c(c2c2ccccc2)cccc1
InChI:
InChI=1S/C26H17Cl/c27-20-15-16-23-24(17-20)26(19-11-5-2-6-12-19)22-14-8-7-13-21(22)25(23)18-9-3-1-4-10-18/h1-17H
InChIKey:
PLMFIWDPKYXMGE-UHFFFAOYSA-N

Cite this record

CBID:125262 http://www.chembase.cn/molecule-125262.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-chloro-9,10-diphenylanthracene
IUPAC Traditional name
2-chloro-9,10-diphenylanthracene
Synonyms
2-Chloro-9,10-diphenylanthracene
PubChem SID
162219612
PubChem CID
632525
Chemspider ID
549193
Wikipedia Title
2-Chloro-9,10-diphenylanthracene

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 7.8506947  LogD (pH = 7.4) 7.8506947 
Log P 7.8506947  Molar Refractivity 114.0356 cm3
Polarizability 49.694458 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Safety Statements
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REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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