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113719-95-2 | Hexadecanoyl chloride, 2-bromo-3,7,11,15-tetramethyl-
CAS No: 113719-95-2 Catalog No: AG0009GG MDL No:
Product Description
Catalog Number:
AG0009GG
Chemical Name:
Hexadecanoyl chloride, 2-bromo-3,7,11,15-tetramethyl-
CAS Number:
113719-95-2
Molecular Formula:
C20H38BrClO
Molecular Weight:
409.8721
IUPAC Name:
2-bromo-3,7,11,15-tetramethylhexadecanoyl chloride
InChI:
InChI=1S/C20H38BrClO/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19(21)20(22)23/h15-19H,6-14H2,1-5H3
InChI Key:
FAQHRFKZPBANOF-UHFFFAOYSA-N
SMILES:
CC(CCCC(C(C(=O)Cl)Br)C)CCCC(CCCC(C)C)C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.179g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
409.877g/mol
Monoisotopic Mass:
408.179g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
10
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