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Home > Aldehydes > 943112-42-3
943112-42-3 | 3-METHOXY-4-(TETRAHYDRO-FURAN-2-YLMETHOXY)-BENZALDEHYDE
CAS No: 943112-42-3 Catalog No: AG01EM8E MDL No:MFCD09930514
Product Description
Catalog Number:
AG01EM8E
Chemical Name:
3-METHOXY-4-(TETRAHYDRO-FURAN-2-YLMETHOXY)-BENZALDEHYDE
CAS Number:
943112-42-3
Molecular Formula:
C13H16O4
Molecular Weight:
236.2637
MDL Number:
MFCD09930514
IUPAC Name:
3-methoxy-4-(oxolan-2-ylmethoxy)benzaldehyde
InChI:
InChI=1S/C13H16O4/c1-15-13-7-10(8-14)4-5-12(13)17-9-11-3-2-6-16-11/h4-5,7-8,11H,2-3,6,9H2,1H3
InChI Key:
KDHACBMWVXSAHP-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)ccc1OCC1CCCO1
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.267g/mol
Monoisotopic Mass:
236.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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