Home Halogens [2-(3,4-dichlorophenoxy)butyl](methyl)amine

[2-(3,4-dichlorophenoxy)butyl](methyl)amine

CAS No.:
1248775-08-7
Catalog Number:
AG01B1R6
Molecular Formula:
C11H15Cl2NO
Molecular Weight:
248.1489
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Product Description
Catalog Number:
AG01B1R6
Chemical Name:
[2-(3,4-dichlorophenoxy)butyl](methyl)amine
CAS Number:
1248775-08-7
Molecular Formula:
C11H15Cl2NO
Molecular Weight:
248.1489
MDL Number:
MFCD16764733
IUPAC Name:
2-(3,4-dichlorophenoxy)-N-methylbutan-1-amine
InChI:
InChI=1S/C11H15Cl2NO/c1-3-8(7-14-2)15-9-4-5-10(12)11(13)6-9/h4-6,8,14H,3,7H2,1-2H3
InChI Key:
COARTXZNHUMTTK-UHFFFAOYSA-N
SMILES:
CNCC(Oc1ccc(c(c1)Cl)Cl)CC
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.147g/mol
Monoisotopic Mass:
247.053g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties