Home Halogens 1-{2-[(2-aminoethyl)sulfanyl]ethoxy}-3-bromobenzene

1-{2-[(2-aminoethyl)sulfanyl]ethoxy}-3-bromobenzene

CAS No.:
1082443-87-5
Catalog Number:
AG01AHGJ
Molecular Formula:
C10H14BrNOS
Molecular Weight:
276.1933
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Product Description
Catalog Number:
AG01AHGJ
Chemical Name:
1-{2-[(2-aminoethyl)sulfanyl]ethoxy}-3-bromobenzene
CAS Number:
1082443-87-5
Molecular Formula:
C10H14BrNOS
Molecular Weight:
276.1933
MDL Number:
MFCD11577801
IUPAC Name:
2-[2-(3-bromophenoxy)ethylsulfanyl]ethanamine
InChI:
InChI=1S/C10H14BrNOS/c11-9-2-1-3-10(8-9)13-5-7-14-6-4-12/h1-3,8H,4-7,12H2
InChI Key:
ICOXAMUEBNDJNL-UHFFFAOYSA-N
SMILES:
NCCSCCOc1cccc(c1)Br
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.998g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
276.192g/mol
Monoisotopic Mass:
274.998g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties