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90300-43-9 | 2H-1-Benzopyran-7-carboxaldehyde, 6-hydroxy-2,2-dimethyl-
CAS No: 90300-43-9 Catalog No: AG006SNF MDL No:
Product Description
Catalog Number:
AG006SNF
Chemical Name:
2H-1-Benzopyran-7-carboxaldehyde, 6-hydroxy-2,2-dimethyl-
CAS Number:
90300-43-9
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
IUPAC Name:
6-hydroxy-2,2-dimethylchromene-7-carbaldehyde
InChI:
InChI=1S/C12H12O3/c1-12(2)4-3-8-5-10(14)9(7-13)6-11(8)15-12/h3-7,14H,1-2H3
InChI Key:
MUOOROCNPQUEBG-UHFFFAOYSA-N
SMILES:
O=Cc1cc2OC(C)(C)C=Cc2cc1O
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.225g/mol
Monoisotopic Mass:
204.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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