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56252-09-6 | 2,3-Dimethoxy-1-naphthaldehyde
CAS No: 56252-09-6 Catalog No: AG003FJF MDL No:MFCD06798095
Product Description
Catalog Number:
AG003FJF
Chemical Name:
2,3-Dimethoxy-1-naphthaldehyde
CAS Number:
56252-09-6
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
MDL Number:
MFCD06798095
IUPAC Name:
2,3-dimethoxynaphthalene-1-carbaldehyde
InChI:
InChI=1S/C13H12O3/c1-15-12-7-9-5-3-4-6-10(9)11(8-14)13(12)16-2/h3-8H,1-2H3
InChI Key:
VTUMHIXLEZHVEJ-UHFFFAOYSA-N
SMILES:
COc1cc2ccccc2c(c1OC)C=O
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.236g/mol
Monoisotopic Mass:
216.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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