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23731-66-0 | 1,3-Benzodioxole-4-carboxaldehyde, 6,7-dimethoxy-
CAS No: 23731-66-0 Catalog No: AG007NGG MDL No:
Product Description
Catalog Number:
AG007NGG
Chemical Name:
1,3-Benzodioxole-4-carboxaldehyde, 6,7-dimethoxy-
CAS Number:
23731-66-0
Molecular Formula:
C10H10O5
Molecular Weight:
210.1834
IUPAC Name:
6,7-dimethoxy-1,3-benzodioxole-4-carbaldehyde
InChI:
InChI=1S/C10H10O5/c1-12-7-3-6(4-11)8-10(9(7)13-2)15-5-14-8/h3-4H,5H2,1-2H3
InChI Key:
IXAPAMZBUJTKNY-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c2c(c1OC)OCO2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.185g/mol
Monoisotopic Mass:
210.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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