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442128-86-1 molecular structure
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6-chloro-3-methylpyridin-2-amine

ChemBase ID: 801943
Molecular Formular: C6H7ClN2
Molecular Mass: 142.58618
Monoisotopic Mass: 142.02977591
SMILES and InChIs

SMILES:
n1c(c(ccc1Cl)C)N
Canonical SMILES:
Clc1ccc(c(n1)N)C
InChI:
InChI=1S/C6H7ClN2/c1-4-2-3-5(7)9-6(4)8/h2-3H,1H3,(H2,8,9)
InChIKey:
UTZHXEYDIWFKTC-UHFFFAOYSA-N

Cite this record

CBID:801943 http://www.chembase.cn/molecule-801943.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
6-chloro-3-methylpyridin-2-amine
IUPAC Traditional name
6-chloro-3-methylpyridin-2-amine
Synonyms
2-PYRIDINAMINE, 6-CHLORO-3-METHYL-
CAS Number
442128-86-1

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O18318 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O18318 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Polar Surface Area 38.91 Å2 Rotatable Bonds
Lipinski's Rule of Five true  H Acceptors
H Donor LogD (pH = 5.5) 1.8560812 
LogD (pH = 7.4) 1.8587146  Log P 1.8587482 
Molar Refractivity 39.8223 cm3 Polarizability 14.273623 Å3

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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INTERNET

INTERNET

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