Home Other Building Blocks P-NITROPHENYL OCTADECYL ETHER

P-NITROPHENYL OCTADECYL ETHER

CAS No.:
123974-61-8
Catalog Number:
AG009DC9
Molecular Formula:
C24H41NO3
Molecular Weight:
391.5872
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Product Description
Catalog Number:
AG009DC9
Chemical Name:
P-NITROPHENYL OCTADECYL ETHER
CAS Number:
123974-61-8
Molecular Formula:
C24H41NO3
Molecular Weight:
391.5872
MDL Number:
MFCD00024681
IUPAC Name:
1-nitro-4-octadecoxybenzene
InChI:
InChI=1S/C24H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-28-24-20-18-23(19-21-24)25(26)27/h18-21H,2-17,22H2,1H3
InChI Key:
JJZZSCOZPPVDBT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCOc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.309g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
391.596g/mol
Monoisotopic Mass:
391.309g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.7  
Properties