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100129-45-1,MFCD02973606
Catalog No.:AA0000YT
Propanamide, 3-chloro-N-ethyl-N-phenyl- | 100129-45-1
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1g
95%
in stock  
$62.00
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5g
95%
in stock  
$158.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000YT
Chemical Name:
Propanamide, 3-chloro-N-ethyl-N-phenyl-
CAS Number:
100129-45-1
Molecular Formula:
C11H14ClNO
Molecular Weight:
211.6880
MDL Number:
MFCD02973606
IUPAC Name:
3-chloro-N-ethyl-N-phenylpropanamide
InChI:
InChI=1S/C11H14ClNO/c1-2-13(11(14)8-9-12)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChI Key:
UXMLUSLRVFUINU-UHFFFAOYSA-N
SMILES:
CCN(c1ccccc1)C(=O)CCCl
Properties
Computed Properties
 
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.076g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.689g/mol
Monoisotopic Mass:
211.076g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
3-chloro-N-ethyl-N-phenylpropanamide 
100129-45-1 
7096AC 
MFCD02973606 
AKOS000142539 
AJ-55390 
FT-0684074 
W-9895 
I14-28806 
C11H14ClNO 
3-chloro-N-ethyl-N-phenyl-propanamide 
CID3271269 
propanamide, 3-chloro-N-ethyl-N-phenyl- 
AC1MN456 
CTK3J8570 
DTXSID90390886 
ALBB-016624 
ZINC5979365 
ZX-AN015316 
ZX-CM015522 
Literature
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