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4105-95-7 | 4-(Octadecyloxy)benzaldehyde
CAS No: 4105-95-7 Catalog No: AG003LXP MDL No:MFCD00143357
Product Description
Catalog Number:
AG003LXP
Chemical Name:
4-(Octadecyloxy)benzaldehyde
CAS Number:
4105-95-7
Molecular Formula:
C25H42O2
Molecular Weight:
374.5998
MDL Number:
MFCD00143357
IUPAC Name:
4-octadecoxybenzaldehyde
InChI:
InChI=1S/C25H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-27-25-20-18-24(23-26)19-21-25/h18-21,23H,2-17,22H2,1H3
InChI Key:
AKTNFINCBVUXEH-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCOc1ccc(cc1)C=O
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.318g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.609g/mol
Monoisotopic Mass:
374.318g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.3
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