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4746-87-6 molecular structure
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2-hydroxy-2,2-diphenylacetamide

ChemBase ID: 109874
Molecular Formular: C14H13NO2
Molecular Mass: 227.25852
Monoisotopic Mass: 227.09462866
SMILES and InChIs

SMILES:
NC(=O)C(O)(c1ccccc1)c1ccccc1
Canonical SMILES:
NC(=O)C(c1ccccc1)(c1ccccc1)O
InChI:
InChI=1S/C14H13NO2/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,17H,(H2,15,16)
InChIKey:
REQXYFLFNBBIRX-UHFFFAOYSA-N

Cite this record

CBID:109874 http://www.chembase.cn/molecule-109874.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-hydroxy-2,2-diphenylacetamide
IUPAC Traditional name
2-hydroxy-2,2-diphenylacetamide
Synonyms
Diphenylglycolamide
Benzilamide
BENZILIC ACID AMIDE
Benzilamide
2-羟基-2,2-二苯基乙酰胺
CAS Number
4746-87-6
MDL Number
MFCD00008010
PubChem SID
162095366
PubChem CID
78483

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 78483 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 11.506753  H Acceptors
H Donor LogD (pH = 5.5) 1.750604 
LogD (pH = 7.4) 1.7505705  Log P 1.7506045 
Molar Refractivity 65.3043 cm3 Polarizability 25.420427 Å3
Polar Surface Area 63.32 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Purity
98% expand Show data source
Certificate of Analysis
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Empirical Formula (Hill Notation)
C14H13NO2 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05212848 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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