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100129-54-2,MFCD02959561
Catalog No.:AA0000YS
100129-54-2 | Acetamide, 2-chloro-N-[4-(1-methylethoxy)phenyl]-
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1g
95%
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$62.00
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5g
95%
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$158.00
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Technical Information
Catalog Number:
AA0000YS
Chemical Name:
Acetamide, 2-chloro-N-[4-(1-methylethoxy)phenyl]-
CAS Number:
100129-54-2
Molecular Formula:
C11H14ClNO2
Molecular Weight:
227.6874
MDL Number:
MFCD02959561
IUPAC Name:
2-chloro-N-(4-propan-2-yloxyphenyl)acetamide
InChI:
InChI=1S/C11H14ClNO2/c1-8(2)15-10-5-3-9(4-6-10)13-11(14)7-12/h3-6,8H,7H2,1-2H3,(H,13,14)
InChI Key:
HVOJEGURDPDERX-UHFFFAOYSA-N
SMILES:
ClCC(=O)Nc1ccc(cc1)OC(C)C
Properties
Computed Properties
 
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.071g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.688g/mol
Monoisotopic Mass:
227.071g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
100129-54-2 
2-CHLORO-N-(4-ISOPROPOXYPHENYL)ACETAMIDE 
AKOS000104838 
MCULE-7848657858 
AJ-54460 
TL8000035 
ST50401966 
2-chloro-N-[4-(methylethoxy)phenyl]acetamide 
W-9880 
2-Chloro-N-{4-[(propan-2-yl)oxy]phenyl}acetamide 
Acetamide, 2-chloro-N-[4-(1-methylethoxy)phenyl]- 
SCHEMBL1948433 
CTK3J8571 
DTXSID50586102 
CHEMBRDG-BB 6934243 
ZINC5644317 
MFCD02959561 
Acetanilide, 2-chloro-4'-isopropoxy- 
Literature
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