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93206-91-8 | 4-dodecoxy-3-methoxy-benzaldehyde
CAS No: 93206-91-8 Catalog No: AG0065B9 MDL No:
Product Description
Catalog Number:
AG0065B9
Chemical Name:
4-dodecoxy-3-methoxy-benzaldehyde
CAS Number:
93206-91-8
Molecular Formula:
C20H32O3
Molecular Weight:
320.4663
IUPAC Name:
4-dodecoxy-3-methoxybenzaldehyde
InChI:
InChI=1S/C20H32O3/c1-3-4-5-6-7-8-9-10-11-12-15-23-19-14-13-18(17-21)16-20(19)22-2/h13-14,16-17H,3-12,15H2,1-2H3
InChI Key:
DNOUZCXUTYVRSR-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOc1ccc(cc1OC)C=O
NSC Number:
147585
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.235g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.473g/mol
Monoisotopic Mass:
320.235g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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