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82144-78-3 | Pentadecanoicacid, 2-bromo-
CAS No: 82144-78-3 Catalog No: AG0050ZX MDL No:
Product Description
Catalog Number:
AG0050ZX
Chemical Name:
Pentadecanoicacid, 2-bromo-
CAS Number:
82144-78-3
Molecular Formula:
C15H29BrO2
Molecular Weight:
321.2936
IUPAC Name:
2-bromopentadecanoic acid
InChI:
InChI=1S/C15H29BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(16)15(17)18/h14H,2-13H2,1H3,(H,17,18)
InChI Key:
MUXQOFXMCVOPPW-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(C(=O)O)Br
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.135g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.299g/mol
Monoisotopic Mass:
320.135g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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