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1137-69-5 molecular structure
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2-chlorophenazine

ChemBase ID: 288766
Molecular Formular: C12H7ClN2
Molecular Mass: 214.65038
Monoisotopic Mass: 214.02977591
SMILES and InChIs

SMILES:
Clc1cc2nc3ccccc3nc2cc1
Canonical SMILES:
Clc1ccc2c(c1)nc1c(n2)cccc1
InChI:
InChI=1S/C12H7ClN2/c13-8-5-6-11-12(7-8)15-10-4-2-1-3-9(10)14-11/h1-7H
InChIKey:
LYZDGXICDJEHAD-UHFFFAOYSA-N

Cite this record

CBID:288766 http://www.chembase.cn/molecule-288766.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-chlorophenazine
IUPAC Traditional name
2-chlorophenazine
Synonyms
2-Chlorophenazine
CAS Number
1137-69-5
PubChem SID
180674297
PubChem CID
345310

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Bide Pharmatech
BD211908 Please log in.
Data Source Data ID
PubChem 345310 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.664212  LogD (pH = 7.4) 3.6642992 
Log P 3.6643004  Molar Refractivity 57.9614 cm3
Polarizability 25.508282 Å3 Polar Surface Area 25.78 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

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

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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