Name: Name:4H-1,3-Benzodioxin-6-carboxaldehyde,2,2-dimethyl-(9CI)
Brand: Angene
SKU: AG00DDE7
Rating: 90 (10 reviews)

4H-1,3-Benzodioxin-6-carboxaldehyde,2,2-dimethyl-(9CI)

CAS No.:

54030-33-0

Catalog Number:

AG00DDE7

Molecular Formula:

C11H12O3

Molecular Weight:

192.2112

Catalog Number:

AG00DDE7

Chemical Name:

4H-1,3-Benzodioxin-6-carboxaldehyde,2,2-dimethyl-(9CI)

CAS Number:

54030-33-0

Molecular Formula:

C11H12O3

Molecular Weight:

192.2112

MDL Number:

MFCD16293847

IUPAC Name:

2,2-dimethyl-4H-1,3-benzodioxine-6-carbaldehyde

InChI:

InChI=1S/C11H12O3/c1-11(2)13-7-9-5-8(6-12)3-4-10(9)14-11/h3-6H,7H2,1-2H3

InChI Key:

KNGWEAQJZJKFLI-UHFFFAOYSA-N

SMILES:

O=Cc1ccc2c(c1)COC(O2)(C)C

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.214g/mol

Monoisotopic Mass:

192.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5