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176543-46-7 | 4-(Thiophen-2-ylmethoxy)-benzaldehyde
CAS No: 176543-46-7 Catalog No: AG01FD8D MDL No:
Product Description
Catalog Number:
AG01FD8D
Chemical Name:
4-(Thiophen-2-ylmethoxy)-benzaldehyde
CAS Number:
176543-46-7
Molecular Formula:
C12H10O2S
Molecular Weight:
218.2716
IUPAC Name:
4-(thiophen-2-ylmethoxy)benzaldehyde
InChI:
InChI=1S/C12H10O2S/c13-8-10-3-5-11(6-4-10)14-9-12-2-1-7-15-12/h1-8H,9H2
InChI Key:
SJILVQWRIRLHLC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCc1cccs1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.27g/mol
Monoisotopic Mass:
218.04g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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