Home Halogens 1-[(1-amino-2-methylpropan-2-yl)sulfanyl]-4-bromobenzene

1-[(1-amino-2-methylpropan-2-yl)sulfanyl]-4-bromobenzene

CAS No.:
1354952-56-9
Catalog Number:
AG019S3E
Molecular Formula:
C10H14BrNS
Molecular Weight:
260.1939
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Product Description
Catalog Number:
AG019S3E
Chemical Name:
1-[(1-amino-2-methylpropan-2-yl)sulfanyl]-4-bromobenzene
CAS Number:
1354952-56-9
Molecular Formula:
C10H14BrNS
Molecular Weight:
260.1939
MDL Number:
MFCD20501954
IUPAC Name:
2-(4-bromophenyl)sulfanyl-2-methylpropan-1-amine
InChI:
InChI=1S/C10H14BrNS/c1-10(2,7-12)13-9-5-3-8(11)4-6-9/h3-6H,7,12H2,1-2H3
InChI Key:
SKFOVLBLQPMVTK-UHFFFAOYSA-N
SMILES:
NCC(Sc1ccc(cc1)Br)(C)C
Properties
Complexity:
153  
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:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties