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404857-69-8 | 2-(2-Bromoisobutyryloxy)undecylthiol
CAS No: 404857-69-8 Catalog No: AG01FOY6 MDL No:
Product Description
Catalog Number:
AG01FOY6
Chemical Name:
2-(2-Bromoisobutyryloxy)undecylthiol
CAS Number:
404857-69-8
IUPAC Name:
11-sulfanylundecyl 2-bromo-2-methylpropanoate
InChI:
InChI=1S/C15H29BrO2S/c1-15(2,16)14(17)18-12-10-8-6-4-3-5-7-9-11-13-19/h19H,3-13H2,1-2H3
InChI Key:
JVQTWZGZUCJHRV-UHFFFAOYSA-N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.107g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.359g/mol
Monoisotopic Mass:
352.107g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
27.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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