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79294-61-4 | 3-methoxy-4-(nonyloxy)benzaldehyde
CAS No: 79294-61-4 Catalog No: AG0059RB MDL No:
Product Description
Catalog Number:
AG0059RB
Chemical Name:
3-methoxy-4-(nonyloxy)benzaldehyde
CAS Number:
79294-61-4
Molecular Formula:
C17H26O3
Molecular Weight:
278.3865
IUPAC Name:
3-methoxy-4-nonoxybenzaldehyde
InChI:
InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-12-20-16-11-10-15(14-18)13-17(16)19-2/h10-11,13-14H,3-9,12H2,1-2H3
InChI Key:
VNBSIJYYDZHAFL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCOc1ccc(cc1OC)C=O
NSC Number:
147583
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.188g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.392g/mol
Monoisotopic Mass:
278.188g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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