Home Halogens 1-N-benzyl-2-chlorobenzene-1,4-diamine

1-N-benzyl-2-chlorobenzene-1,4-diamine

CAS No.:
104226-32-6
Catalog Number:
AG019WP6
Molecular Formula:
C13H13ClN2
Molecular Weight:
232.7087
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Product Description
Catalog Number:
AG019WP6
Chemical Name:
1-N-benzyl-2-chlorobenzene-1,4-diamine
CAS Number:
104226-32-6
Molecular Formula:
C13H13ClN2
Molecular Weight:
232.7087
MDL Number:
MFCD11187042
IUPAC Name:
1-N-benzyl-2-chlorobenzene-1,4-diamine
InChI:
InChI=1S/C13H13ClN2/c14-12-8-11(15)6-7-13(12)16-9-10-4-2-1-3-5-10/h1-8,16H,9,15H2
InChI Key:
XFSGBXYTDKQHRA-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Cl)NCc1ccccc1
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.077g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
232.711g/mol
Monoisotopic Mass:
232.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties