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894793-16-9 molecular structure
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N-methyl-N-[(2R)-1-phenylpropan-2-yl]formamide

ChemBase ID: 169407
Molecular Formular: C11H15NO
Molecular Mass: 177.2429
Monoisotopic Mass: 177.11536411
SMILES and InChIs

SMILES:
c1cccc(c1)C[C@H](N(C)C=O)C
Canonical SMILES:
O=CN([C@@H](Cc1ccccc1)C)C
InChI:
InChI=1S/C11H15NO/c1-10(12(2)9-13)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3/t10-/m1/s1
InChIKey:
GLSMSUZWTDVJMA-SNVBAGLBSA-N

Cite this record

CBID:169407 http://www.chembase.cn/molecule-169407.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-methyl-N-[(2R)-1-phenylpropan-2-yl]formamide
IUPAC Traditional name
N-methyl-N-[(2R)-1-phenylpropan-2-yl]formamide
Synonyms
N-Methyl-N-[(1R)-1-methyl-2-phenylethyl]formamide
(R)-N-Formyl Methamphetamine
CAS Number
894793-16-9
PubChem SID
162263539
PubChem CID
57487842

DATA SOURCES

DATA SOURCES

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Data Source Data ID
TRC F700705 external link Add to cart
PubChem 57487842 external link
Data Source Data ID Price
TRC
F700705 external link Add to cart Please log in.
Data Source Data ID
PubChem 57487842 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.7980738  LogD (pH = 7.4) 1.7980745 
Log P 1.7980745  Molar Refractivity 53.5552 cm3
Polarizability 20.750843 Å3 Polar Surface Area 20.31 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - F700705 external link
An impurity of (R)-(-)-Methamphetamine (M258791). Controlled substance.

REFERENCES

REFERENCES

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  • • King, S., et al.: Tetrahedron Lett., 35, 5611 (1994)
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PATENTS

PATENTS

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INTERNET

INTERNET

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