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Home > Aldehydes > 893737-31-0
893737-31-0 | Benzaldehyde,4-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS No: 893737-31-0 Catalog No: AG003WXV MDL No:
Product Description
Catalog Number:
AG003WXV
Chemical Name:
Benzaldehyde,4-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS Number:
893737-31-0
Molecular Formula:
C15H12O3
Molecular Weight:
240.2540
IUPAC Name:
4-(2,3-dihydro-1,4-benzodioxin-6-yl)benzaldehyde
InChI:
InChI=1S/C15H12O3/c16-10-11-1-3-12(4-2-11)13-5-6-14-15(9-13)18-8-7-17-14/h1-6,9-10H,7-8H2
InChI Key:
NSKIBMMZVKNHEM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccc2c(c1)OCCO2
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.258g/mol
Monoisotopic Mass:
240.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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