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11-?(2-?Bromoisobutyrate)?-?undecyl-?1-?phosphonic acid

Catalog NumberACM1095957235

CAS Number1095957-23-5

CategorySelf-Assembly Materials

IUPAC Name
11-(2-bromo-2-methylpropanoyl)oxyundecylphosphonic acid
Molecular Weight
401.27g/mol
Molecular Formula
C15H30BrO5P
Canonical SMILES
CC(C)(C(=O)OCCCCCCCCCCCP(=O)(O)O)Br
InChI
InChI=1S/C15H30BrO5P/c1-15(2,16)14(17)21-12-10-8-6-4-3-5-7-9-11-13-22(18,19)20/h3-13H2,1-2H3,(H2,18,19,20)
InChI Key
SBFNQWAMVLRANY-UHFFFAOYSA-N
Complexity
354
Covalently-Bonded Unit Count
1
Exact Mass
400.10142g/mol
Formal Charge
0
Heavy Atom Count
22
Monoisotopic Mass
400.10142g/mol
Rotatable Bond Count
14
XLogP3
3.8
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