Home Halogens [3-chloro-4-(3-methylpiperidin-1-yl)phenyl]methanamine

[3-chloro-4-(3-methylpiperidin-1-yl)phenyl]methanamine

CAS No.:
1341165-91-0
Catalog Number:
AG01B8I2
Molecular Formula:
C13H19ClN2
Molecular Weight:
238.7564
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Product Description
Catalog Number:
AG01B8I2
Chemical Name:
[3-chloro-4-(3-methylpiperidin-1-yl)phenyl]methanamine
CAS Number:
1341165-91-0
Molecular Formula:
C13H19ClN2
Molecular Weight:
238.7564
MDL Number:
MFCD17291190
IUPAC Name:
[3-chloro-4-(3-methylpiperidin-1-yl)phenyl]methanamine
InChI:
InChI=1S/C13H19ClN2/c1-10-3-2-6-16(9-10)13-5-4-11(8-15)7-12(13)14/h4-5,7,10H,2-3,6,8-9,15H2,1H3
InChI Key:
NKYVEBZXFQSYFG-UHFFFAOYSA-N
SMILES:
NCc1ccc(c(c1)Cl)N1CCCC(C1)C
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.124g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.759g/mol
Monoisotopic Mass:
238.124g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties