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

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

CAS No.:
1311316-15-0
Catalog Number:
AG01AIQU
Molecular Formula:
C10H15BrClNS
Molecular Weight:
296.6548
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Product Description
Catalog Number:
AG01AIQU
Chemical Name:
1-[(4-aminobutyl)sulfanyl]-2-bromobenzene hydrochloride
CAS Number:
1311316-15-0
Molecular Formula:
C10H15BrClNS
Molecular Weight:
296.6548
MDL Number:
MFCD18917379
IUPAC Name:
4-(2-bromophenyl)sulfanylbutan-1-amine;hydrochloride
InChI:
InChI=1S/C10H14BrNS.ClH/c11-9-5-1-2-6-10(9)13-8-4-3-7-12;/h1-2,5-6H,3-4,7-8,12H2;1H
InChI Key:
WUJVVJSIBJOZRY-UHFFFAOYSA-N
SMILES:
NCCCCSc1ccccc1Br.Cl
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.98g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
296.651g/mol
Monoisotopic Mass:
294.98g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties