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21447-53-0,MFCD09043756
Catalog No.:AA01AJND
21447-53-0 | 2-methyl-5-(morpholine-4-carbonyl)aniline
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
3 weeks  
$194.00
- +
250mg
95.0%
3 weeks  
$260.00
- +
500mg
95.0%
3 weeks  
$466.00
- +
1g
95.0%
3 weeks  
$656.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA01AJND
Chemical Name:
2-methyl-5-(morpholine-4-carbonyl)aniline
CAS Number:
21447-53-0
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
MDL Number:
MFCD09043756
IUPAC Name:
(3-amino-4-methylphenyl)-morpholin-4-ylmethanone
InChI:
InChI=1S/C12H16N2O2/c1-9-2-3-10(8-11(9)13)12(15)14-4-6-16-7-5-14/h2-3,8H,4-7,13H2,1H3
InChI Key:
KAUCCBZBIGZLFO-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)N)C)N1CCOCC1
Properties
Computed Properties
 
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

Synonyms
 
2-methyl-5-(morpholine-4-carbonyl)aniline 
21447-53-0 
2-methyl-5-[(morpholin-4-yl)carbonyl]aniline 
2-METHYL-5-(MORPHOLIN-4-YLCARBONYL)ANILINE 
(3-Amino-4-methyl-phenyl)-morpholin-4-yl-m ethanone 
Methanone, (3-amino-4-methylphenyl)-4-morpholinyl- 
SCHEMBL3226524 
CTK7F6639 
ZINC20194713 
AKOS000111607 
NE26797 
BB 0246488 
EN300-81687 
Literature
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