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26163-06-4 molecular structure
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5-chloro-N,N-dimethylpyridin-2-amine

ChemBase ID: 814934
Molecular Formular: C7H9ClN2
Molecular Mass: 156.61276
Monoisotopic Mass: 156.04542598
SMILES and InChIs

SMILES:
n1c(ccc(c1)Cl)N(C)C
Canonical SMILES:
Clc1ccc(nc1)N(C)C
InChI:
InChI=1S/C7H9ClN2/c1-10(2)7-4-3-6(8)5-9-7/h3-5H,1-2H3
InChIKey:
VZQQSMKAAURLQZ-UHFFFAOYSA-N

Cite this record

CBID:814934 http://www.chembase.cn/molecule-814934.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-chloro-N,N-dimethylpyridin-2-amine
IUPAC Traditional name
5-chloro-N,N-dimethylpyridin-2-amine
Synonyms
5-chloro-N,N-dimethylpyridin-2-amine
CAS Number
26163-06-4

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O37173 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O37173 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.022518  LogD (pH = 7.4) 2.0615962 
Log P 2.0621195  Molar Refractivity 43.448 cm3
Polarizability 16.1264 Å3 Polar Surface Area 16.13 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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