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Home Amines 101-45-1
101-45-1,MFCD28048228
Catalog No.:AA0003CJ
101-45-1 | Ethanol, 2-[(1-methyl-2-phenoxyethyl)(phenylmethyl)amino]-
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Technical Information
Catalog Number:
AA0003CJ
Chemical Name:
Ethanol, 2-[(1-methyl-2-phenoxyethyl)(phenylmethyl)amino]-
CAS Number:
101-45-1
Molecular Formula:
C18H23NO2
Molecular Weight:
285.3807
MDL Number:
MFCD28048228
IUPAC Name:
2-[benzyl(1-phenoxypropan-2-yl)amino]ethanol
InChI:
InChI=1S/C18H23NO2/c1-16(15-21-18-10-6-3-7-11-18)19(12-13-20)14-17-8-4-2-5-9-17/h2-11,16,20H,12-15H2,1H3
InChI Key:
LYNJRXJVOBYDCM-UHFFFAOYSA-N
SMILES:
OCCN(C(COc1ccccc1)C)Cc1ccccc1
EC Number:
202-944-0
Properties
Computed Properties
 
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.173g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.387g/mol
Monoisotopic Mass:
285.173g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Synonyms
 
101-45-1 
2-[BENZYL(1-METHYL-2-PHENOXYETHYL)AMINO]ETHANOL 
Ethanol, 2-[(1-methyl-2-phenoxyethyl)(phenylmethyl)amino]- 
2-[N-(1-Methyl-2-phenoxyethyl)-N-benzylamino]ethanol 
Ethanol,2-[(1-methyl-2-phenoxyethyl)(phenylmethyl)amino]- 
C18H23NO2 
AR-1D7026 
C18-H23-N-O2 
CID101573 
Ethanol, 2-[benzyl(1-methyl-2-phenoxyethyl)amino]- 
Ethanol, 2-((1-methyl-2-phenoxyethyl)(phenylmethyl)amino)- 
10193-98-3 
2-[benzyl(1-phenoxypropan-2-yl)amino]ethanol 
2-(Benzyl(1-methyl-2-phenoxyethyl)amino)ethanol 
EINECS 202-944-0 
Phenoxybenzamine Alcohol 
AC1Q57JL 
AC1L2R44 
SCHEMBL19958436 
CTK3J9803 
Literature
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