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34631-53-3 molecular structure
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4-ethyl-1,3-thiazol-2-amine

ChemBase ID: 308908
Molecular Formular: C5H8N2S
Molecular Mass: 128.19542
Monoisotopic Mass: 128.04081927
SMILES and InChIs

SMILES:
n1c(scc1CC)N
Canonical SMILES:
CCc1csc(n1)N
InChI:
InChI=1S/C5H8N2S/c1-2-4-3-8-5(6)7-4/h3H,2H2,1H3,(H2,6,7)
InChIKey:
JJDSGHBAXFTEHZ-UHFFFAOYSA-N

Cite this record

CBID:308908 http://www.chembase.cn/molecule-308908.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-ethyl-1,3-thiazol-2-amine
IUPAC Traditional name
4-ethyl-1,3-thiazol-2-amine
Synonyms
4-ethyl-1,3-thiazol-2-amine
CAS Number
34631-53-3
MDL Number
MFCD13179620

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.22708  LogD (pH = 7.4) 1.3179686 
Log P 1.3192687  Molar Refractivity 34.6585 cm3
Polarizability 12.85434 Å3 Polar Surface Area 38.91 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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