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150619-66-2

150619-66-2 | Benzene, 2-butoxy-5-hexadecyl-1,3-dimethyl-

CAS No: 150619-66-2 Catalog No: AG001MRB MDL No:

Product Description

Catalog Number:
AG001MRB
Chemical Name:
Benzene, 2-butoxy-5-hexadecyl-1,3-dimethyl-
CAS Number:
150619-66-2
Molecular Formula:
C28H50O
Molecular Weight:
402.6960
IUPAC Name:
2-butoxy-5-hexadecyl-1,3-dimethylbenzene
InChI:
InChI=1S/C28H50O/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-27-23-25(3)28(26(4)24-27)29-22-8-6-2/h23-24H,5-22H2,1-4H3
InChI Key:
TWMZXLHIKJSJEY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCc1cc(C)c(c(c1)C)OCCCC

Properties

Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.386g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.707g/mol
Monoisotopic Mass:
402.386g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.3  

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