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Home > Aldehydes > 128139-63-9
128139-63-9 | Benzaldehyde, 4-butoxy-3-methoxy-5-(2-propen-1-yl)-
CAS No: 128139-63-9 Catalog No: AG000XTX MDL No:MFCD08691694
Product Description
Catalog Number:
AG000XTX
Chemical Name:
Benzaldehyde, 4-butoxy-3-methoxy-5-(2-propen-1-yl)-
CAS Number:
128139-63-9
Molecular Formula:
C15H20O3
Molecular Weight:
248.3175
MDL Number:
MFCD08691694
IUPAC Name:
4-butoxy-3-methoxy-5-prop-2-enylbenzaldehyde
InChI:
InChI=1S/C15H20O3/c1-4-6-8-18-15-13(7-5-2)9-12(11-16)10-14(15)17-3/h5,9-11H,2,4,6-8H2,1,3H3
InChI Key:
DUUDAGLUGZXHRC-UHFFFAOYSA-N
SMILES:
CCCCOc1c(CC=C)cc(cc1OC)C=O
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.141g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.322g/mol
Monoisotopic Mass:
248.141g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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