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85944-02-1 | Benzaldehyde, 5-ethyl-2-methoxy-
CAS No: 85944-02-1 Catalog No: AG004QLO MDL No:MFCD06247461
Product Description
Catalog Number:
AG004QLO
Chemical Name:
Benzaldehyde, 5-ethyl-2-methoxy-
CAS Number:
85944-02-1
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD06247461
IUPAC Name:
5-ethyl-2-methoxybenzaldehyde
InChI:
InChI=1S/C10H12O2/c1-3-8-4-5-10(12-2)9(6-8)7-11/h4-7H,3H2,1-2H3
InChI Key:
FPVAAACXONVFMQ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(CC)ccc1OC
Properties
Complexity:
145
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:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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