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2-Bromohexadecanoic acid

Catalog Number ACM18263257-1
CAS 18263-25-7
Structure {[CurrentData.Name]}
IUPAC Name 2-bromohexadecanoic acid
Synonyms 2-Bromohexadecanoic acid;18263-25-7;2-Bromopalmitic acid;Hexadecanoic acid, 2-bromo-;2-bromo-hexadecanoic acid;alpha-Bromopalmitic acid;Hexadecanoic acid,2-bromo-;.alpha.-Bromopalmitic acid;CHEMBL118417;MFCD00004215;2-Bromopalmitate;EINECS 242-137-0;NSC 58378;bromohexadecanoic acid;ACMC-1C7OL;2-bromanylhexadecanoic acid;DSSTox_CID_17734;DSSTox_RID_79368;NCIOpen2_007723;DSSTox_GSID_37734;SCHEMBL97565;DTXSID0037734;2-Bromohexadecanoic acid, ~97%;CHEBI:133152;NSC58378;Tox21_301033;BDBM50148454;LMFA01090011;NSC-58378;SBB071635;AKOS003404931;AKOS017343270;MCULE-7613431163;VZ24096;NCGC00164251-01;NCGC00164251-02;NCGC00254935-01;AS-59253;L213;CAS-18263-25-7;2-Bromohexadecanoic acid, >=99.0% (GC);FT-0611564;ST45026694;2-Bromohexadecanoic acid, purum, >=97.0% (GC);A812715;J-011689;Q27268159
Molecular Weight 335.32g/mol
Molecular Formula C16H31BrO2
Canonical SMILES CCCCCCCCCCCCCCC(C(=O)O)Br
InChI InChI=1S/C16H31BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19/h15H,2-14H2,1H3,(H,18,19)
InChI Key DPRAYRYQQAXQPE-UHFFFAOYSA-N
Complexity 207
Covalently-Bonded Unit Count 1
EC Number 242-137-0
Exact Mass 334.15074g/mol
Heavy Atom Count 19
Hydrogen Bond Acceptor Count 2
Monoisotopic Mass 334.15074g/mol
NSC Number 58378
Rotatable Bond Count 14
Topological Polar Surface Area 37.3Ų
X Log P3 7.8
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