Home Halogens 1-[(4-aminobutyl)sulfanyl]-2-bromobenzene

1-[(4-aminobutyl)sulfanyl]-2-bromobenzene

CAS No.:
799764-02-6
Catalog Number:
AG01AJH0
Molecular Formula:
C10H14BrNS
Molecular Weight:
260.1939
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Product Description
Catalog Number:
AG01AJH0
Chemical Name:
1-[(4-aminobutyl)sulfanyl]-2-bromobenzene
CAS Number:
799764-02-6
Molecular Formula:
C10H14BrNS
Molecular Weight:
260.1939
MDL Number:
MFCD12192170
IUPAC Name:
4-(2-bromophenyl)sulfanylbutan-1-amine
InChI:
InChI=1S/C10H14BrNS/c11-9-5-1-2-6-10(9)13-8-4-3-7-12/h1-2,5-6H,3-4,7-8,12H2
InChI Key:
RMEASPJCKBNAKY-UHFFFAOYSA-N
SMILES:
NCCCCSc1ccccc1Br
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.003g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.193g/mol
Monoisotopic Mass:
259.003g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties