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Home > Aldehydes > 838882-69-2
838882-69-2 | 3-methoxy-4-(thiophen-2-ylmethoxy)benzaldehyde
CAS No: 838882-69-2 Catalog No: AG019O5B MDL No:MFCD06633889
Product Description
Catalog Number:
AG019O5B
Chemical Name:
3-methoxy-4-(thiophen-2-ylmethoxy)benzaldehyde
CAS Number:
838882-69-2
Molecular Formula:
C13H12O3S
Molecular Weight:
248.2976
MDL Number:
MFCD06633889
IUPAC Name:
3-methoxy-4-(thiophen-2-ylmethoxy)benzaldehyde
InChI:
InChI=1S/C13H12O3S/c1-15-13-7-10(8-14)4-5-12(13)16-9-11-3-2-6-17-11/h2-8H,9H2,1H3
InChI Key:
PYGQNTIOGIZNFR-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)ccc1OCc1cccs1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.296g/mol
Monoisotopic Mass:
248.051g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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