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Home > Aldehydes > 115319-76-1
115319-76-1 | Benzaldehyde, 3-hydroxy-2-methoxy-6-(methoxymethyl)-
CAS No: 115319-76-1 Catalog No: AG000GLQ MDL No:
Product Description
Catalog Number:
AG000GLQ
Chemical Name:
Benzaldehyde, 3-hydroxy-2-methoxy-6-(methoxymethyl)-
CAS Number:
115319-76-1
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
IUPAC Name:
3-hydroxy-2-methoxy-6-(methoxymethyl)benzaldehyde
InChI:
InChI=1S/C10H12O4/c1-13-6-7-3-4-9(12)10(14-2)8(7)5-11/h3-5,12H,6H2,1-2H3
InChI Key:
SXPFIFUYWIGWNK-UHFFFAOYSA-N
SMILES:
COCc1ccc(c(c1C=O)OC)O
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.202g/mol
Monoisotopic Mass:
196.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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