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100800-40-6,MFCD11593604
Catalog No.:AA0002U5
100800-40-6 | 4-(3-Morpholinopropoxy)aniline
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250mg
95%
1 week  
$235.00   $165.00
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Technical Information
Catalog Number:
AA0002U5
Chemical Name:
4-(3-Morpholinopropoxy)aniline
CAS Number:
100800-40-6
Molecular Formula:
C13H20N2O2
Molecular Weight:
236.3101
MDL Number:
MFCD11593604
IUPAC Name:
4-(3-morpholin-4-ylpropoxy)aniline
InChI:
InChI=1S/C13H20N2O2/c14-12-2-4-13(5-3-12)17-9-1-6-15-7-10-16-11-8-15/h2-5H,1,6-11,14H2
InChI Key:
KDHPQNXUMCNVCX-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)OCCCN1CCOCC1
Properties
Computed Properties
 
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.152g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.315g/mol
Monoisotopic Mass:
236.152g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Synonyms
 
4-(3-MORPHOLINOPROPOXY)ANILINE 
100800-40-6 
ZINC19731919 
AKOS009394902 
MCULE-8229774652 
SEL10310363 
4-(3-Morpholin-4-yl-propoxy)phenylamine 
NS-03197 
4-(3-morpholin-4-yl-propoxy)-phenylamine 
AB0078673 
AX8242176 
X-2096 
Benzenamine, 4-[3-(4-morpholinyl)propoxy]- 
4-(3-morpholin-4-yl-propoxy)-aniline 
4-[3-(Morpholin-4-yl)propoxy]aniline 
ACMC-20m3uy 
SCHEMBL374569 
CTK0G8622 
DTXSID20622142 
KDHPQNXUMCNVCX-UHFFFAOYSA-N 
MFCD11593604 
Literature
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