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67698-61-7 | 3-Propoxybenzaldehyde
CAS No: 67698-61-7 Catalog No: AG005QLM MDL No:MFCD01993679
Product Description
Catalog Number:
AG005QLM
Chemical Name:
3-Propoxybenzaldehyde
CAS Number:
67698-61-7
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD01993679
IUPAC Name:
3-propoxybenzaldehyde
InChI:
InChI=1S/C10H12O2/c1-2-6-12-10-5-3-4-9(7-10)8-11/h3-5,7-8H,2,6H2,1H3
InChI Key:
GFFJBSXKNZDYOJ-UHFFFAOYSA-N
SMILES:
CCCOc1cccc(c1)C=O
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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