열여덟

1. 이름 및 식별자

1.2 동의어: 1-PHENYLOCTADECANE; 2-Phenyloctadecane; Benzene, octadecyl-; benzene,octadecyl-; n-Octadecylbenzene; NSC 41235; Octadecane, 1-phenyl-; octadecane,1-phenyl-; octadecyl-benzen; Octadecylbenzene; Stearylbenzene;

1.7 Inchi: InChI=1S/C24H42/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-24-22-19-17-20-23-24/h17,19-20,22-23H,2-16,18,21H2,1H3

2. NMR 스펙트럼

13C NMR : in CDCl3

1H NMR : 90 MHz in CDCl3

IR : KBr disc

IR : nujol mull

Mass

3. 합성 선형

4445-07-2Total: 7 합성 선형

71-43-2 202 공급자

4445-07-2 17 공급자

112-76-5 53 공급자

4445-07-2 17 공급자

4. 전구체 및 제품

업스트림 제품:

71-43-2

6786-36-3

112-76-5

629-93-6

591-50-4

7446-70-0

112-89-0

112-92-5

다운스트림 제품:

79840-57-6

33327-30-9

114235-67-5

4445-06-1

5. 화학 데이터 계산

Molecular Weight：330.6g/mol
Molecular Formula：C₂₄H₄₂
Compound Is Canonicalized：True
XLogP3-AA：330.328651340
Monoisotopic Mass：330.328651340
Complexity：226
Rotatable Bond Count：17
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：0
Topological Polar Surface Area：0
Heavy Atom Count：：24
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADcfB4AAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGAAAAAAADACAGAAyAIAAAACAAiBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAgMAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==