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Home > Aldehydes > 942474-73-9
942474-73-9 | 4-Methoxy-2-methylsulfonylbenzaldehyde
CAS No: 942474-73-9 Catalog No: AG01EZG8 MDL No:
Product Description
Catalog Number:
AG01EZG8
Chemical Name:
4-Methoxy-2-methylsulfonylbenzaldehyde
CAS Number:
942474-73-9
Molecular Formula:
C9H10O4S
Molecular Weight:
214.2383
IUPAC Name:
4-methoxy-2-methylsulfonylbenzaldehyde
InChI:
InChI=1S/C9H10O4S/c1-13-8-4-3-7(6-10)9(5-8)14(2,11)12/h3-6H,1-2H3
InChI Key:
WPUQQJDOOBDUAN-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)S(=O)(=O)C)C=O
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.03g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.235g/mol
Monoisotopic Mass:
214.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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