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51936-80-2 molecular structure
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2-hydroxy-2-phenylethanimidamide

ChemBase ID: 307230
Molecular Formular: C8H10N2O
Molecular Mass: 150.1778
Monoisotopic Mass: 150.07931295
SMILES and InChIs

SMILES:
C(=N)(C(c1ccccc1)O)N
Canonical SMILES:
OC(c1ccccc1)C(=N)N
InChI:
InChI=1S/C8H10N2O/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5,7,11H,(H3,9,10)
InChIKey:
AFXGCWGNLJLYEZ-UHFFFAOYSA-N

Cite this record

CBID:307230 http://www.chembase.cn/molecule-307230.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-hydroxy-2-phenylethanimidamide
IUPAC Traditional name
2-hydroxy-2-phenylethanimidamide
Synonyms
2-hydroxy-2-phenylethanimidamide
CAS Number
51936-80-2
MDL Number
MFCD01664377

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) -2.2350826  LogD (pH = 7.4) -1.5578351 
Log P 0.15872121  Molar Refractivity 53.1201 cm3
Polarizability 16.484758 Å3 Polar Surface Area 70.1 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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