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1443345-66-1 | 3-[(Tetrahydrofurfuryloxy)methyl]benzaldehyde
CAS No: 1443345-66-1 Catalog No: AG01FAFE MDL No:
Product Description
Catalog Number:
AG01FAFE
Chemical Name:
3-[(Tetrahydrofurfuryloxy)methyl]benzaldehyde
CAS Number:
1443345-66-1
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
IUPAC Name:
3-(oxolan-2-ylmethoxymethyl)benzaldehyde
InChI:
InChI=1S/C13H16O3/c14-8-11-3-1-4-12(7-11)9-15-10-13-5-2-6-16-13/h1,3-4,7-8,13H,2,5-6,9-10H2
InChI Key:
ZTARXEHHLSIXEB-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)COCC1CCCO1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.268g/mol
Monoisotopic Mass:
220.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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