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143360-01-4 molecular structure
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N-(4-bromo-2-methoxyphenyl)acetamide

ChemBase ID: 311922
Molecular Formular: C9H10BrNO2
Molecular Mass: 244.0852
Monoisotopic Mass: 242.98949057
SMILES and InChIs

SMILES:
N(c1c(cc(cc1)Br)OC)C(=O)C
Canonical SMILES:
COc1cc(Br)ccc1NC(=O)C
InChI:
InChI=1S/C9H10BrNO2/c1-6(12)11-8-4-3-7(10)5-9(8)13-2/h3-5H,1-2H3,(H,11,12)
InChIKey:
OXHBMBUYHWMWKM-UHFFFAOYSA-N

Cite this record

CBID:311922 http://www.chembase.cn/molecule-311922.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-(4-bromo-2-methoxyphenyl)acetamide
IUPAC Traditional name
2-methoxy-4-bromoacetanilide
Synonyms
N-(4-bromo-2-methoxyphenyl)acetamide
CAS Number
143360-01-4
MDL Number
MFCD00460756

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.8220375  LogD (pH = 7.4) 1.8220347 
Log P 1.8220376  Molar Refractivity 55.007 cm3
Polarizability 20.601719 Å3 Polar Surface Area 38.33 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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