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Home > Aldehydes > 116757-66-5
116757-66-5 | 1,4-Benzodioxin-6-carboxaldehyde, 2,3-dihydro-7-methoxy-
CAS No: 116757-66-5 Catalog No: AG000D6J MDL No:MFCD08144775
Product Description
Catalog Number:
AG000D6J
Chemical Name:
1,4-Benzodioxin-6-carboxaldehyde, 2,3-dihydro-7-methoxy-
CAS Number:
116757-66-5
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD08144775
IUPAC Name:
6-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbaldehyde
InChI:
InChI=1S/C10H10O4/c1-12-8-5-10-9(4-7(8)6-11)13-2-3-14-10/h4-6H,2-3H2,1H3
InChI Key:
KAMBUYABGSQMFF-UHFFFAOYSA-N
SMILES:
O=Cc1cc2OCCOc2cc1OC
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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