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Home > Aldehydes > 909853-98-1
909853-98-1 | 3-ETHOXY-4-[(3-METHYL-2-BUTEN-1-YL)OXY]BENZALDEHYDE
CAS No: 909853-98-1 Catalog No: AG006G53 MDL No:MFCD08691986
Product Description
Catalog Number:
AG006G53
Chemical Name:
3-ETHOXY-4-[(3-METHYL-2-BUTEN-1-YL)OXY]BENZALDEHYDE
CAS Number:
909853-98-1
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
MDL Number:
MFCD08691986
IUPAC Name:
3-ethoxy-4-(3-methylbut-2-enoxy)benzaldehyde
InChI:
InChI=1S/C14H18O3/c1-4-16-14-9-12(10-15)5-6-13(14)17-8-7-11(2)3/h5-7,9-10H,4,8H2,1-3H3
InChI Key:
XRMYEOWPLMERRA-UHFFFAOYSA-N
SMILES:
CCOc1cc(C=O)ccc1OCC=C(C)C
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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