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638-58-4 molecular structure
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tetradecanamide

ChemBase ID: 108987
Molecular Formular: C14H29NO
Molecular Mass: 227.38616
Monoisotopic Mass: 227.22491455
SMILES and InChIs

SMILES:
CCCCCCCCCCCCCC(=O)N
Canonical SMILES:
CCCCCCCCCCCCCC(=O)N
InChI:
InChI=1S/C14H29NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H2,15,16)
InChIKey:
QEALYLRSRQDCRA-UHFFFAOYSA-N

Cite this record

CBID:108987 http://www.chembase.cn/molecule-108987.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tetradecanamide
IUPAC Traditional name
tetradecanamide
Synonyms
MYRISTICAMIDE
Myristamide
n-Tetradecanamide
正十四烷基铵
CAS Number
638-58-4
EC Number
211-343-2
MDL Number
MFCD00025533
PubChem SID
162106226
PubChem CID
69492

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 69492 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 16.88392  H Acceptors
H Donor LogD (pH = 5.5) 4.560503 
LogD (pH = 7.4) 4.560503  Log P 4.560503 
Molar Refractivity 69.7038 cm3 Polarizability 27.736353 Å3
Polar Surface Area 43.09 Å2 Rotatable Bonds 12 
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
105-107°C expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
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Purity
98% expand Show data source
Certificate of Analysis
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05209441 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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