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116129-34-1 | 1-Undecanethiol, 11-bromo-
CAS No: 116129-34-1 Catalog No: AG000BPQ MDL No:
Product Description
Catalog Number:
AG000BPQ
Chemical Name:
1-Undecanethiol, 11-bromo-
CAS Number:
116129-34-1
Molecular Formula:
C11H23BrS
Molecular Weight:
267.2693
IUPAC Name:
11-bromoundecane-1-thiol
InChI:
InChI=1S/C11H23BrS/c12-10-8-6-4-2-1-3-5-7-9-11-13/h13H,1-11H2
InChI Key:
IKVISLWYYHGTTN-UHFFFAOYSA-N
SMILES:
SCCCCCCCCCCCBr
Properties
Complexity:
86.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.269g/mol
Monoisotopic Mass:
266.07g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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