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840507-47-3 | Dipentaerythritol hexakis(2-bromoisobutyrate)
CAS No: 840507-47-3 Catalog No: AG003POV MDL No:
Product Description
Catalog Number:
AG003POV
Chemical Name:
Dipentaerythritol hexakis(2-bromoisobutyrate)
CAS Number:
840507-47-3
IUPAC Name:
2-bromo-2-methylpropanoic acid;2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol
InChI:
InChI=1S/C10H22O7.6C4H7BrO2/c11-1-9(2-12,3-13)7-17-8-10(4-14,5-15)6-16;6*1-4(2,5)3(6)7/h11-16H,1-8H2;6*1-2H3,(H,6,7)
InChI Key:
NVZQTBSIAGMSCM-UHFFFAOYSA-N
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
7
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1255.908g/mol
Formal Charge:
0
Heavy Atom Count:
59
Hydrogen Bond Acceptor Count:
19
Hydrogen Bond Donor Count:
12
Isotope Atom Count:
0
Molecular Weight:
1256.291g/mol
Monoisotopic Mass:
1249.914g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
354A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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