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2-bromanylhexanoic acid; N,N-didodecyldodecan-1-amine

2-bromanylhexanoic acid; N,N-didodecyldodecan-1-amine

Systemtic Name:2-bromanylhexanoic acid; N,N-didodecyldodecan-1-amine
Openeye Name:2-bromohexanoic acid; N,N-didodecyldodecan-1-amine
CAS Name:2-bromohexanoic acid; N,N-didodecyl-1-dodecanamine
IUPAC Name:2-bromohexanoic acid; N,N-didodecyldodecan-1-amine
Traditional Name:2-bromohexanoic acid; trilaurylamine
Formula: C42H86BrNO2
MolecularWeight: 717.04174
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCCCCCCCCCC.CCCCC(C(=O)O)Br


Isomeric SMILES

CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCCCCCCCCCC.CCCCC(C(=O)O)Br


InChI

InChI=1S/C36H75N.C6H11BrO2/c1-4-7-10-13-16-19-22-25-28-31-34-37(35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3;1-2-3-4-5(7)6(8)9/h4-36H2,1-3H3;5H,2-4H2,1H3,(H,8,9)


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