Name: Name:3-(3,3-dimethyl-2,3-dihydro-1-benzofuran-6-yl)propanal
Brand: Angene
SKU: AG01BVMH
Rating: 90 (10 reviews)

3-(3,3-dimethyl-2,3-dihydro-1-benzofuran-6-yl)propanal

CAS No.:

1440962-00-4

Catalog Number:

AG01BVMH

Molecular Formula:

C13H16O2

Molecular Weight:

204.2649

Catalog Number:

AG01BVMH

Chemical Name:

3-(3,3-dimethyl-2,3-dihydro-1-benzofuran-6-yl)propanal

CAS Number:

1440962-00-4

Molecular Formula:

C13H16O2

Molecular Weight:

204.2649

MDL Number:

MFCD24857255

IUPAC Name:

3-(3,3-dimethyl-2H-1-benzofuran-6-yl)propanal

InChI:

InChI=1S/C13H16O2/c1-13(2)9-15-12-8-10(4-3-7-14)5-6-11(12)13/h5-8H,3-4,9H2,1-2H3

InChI Key:

QKZXKECGTKHFCI-UHFFFAOYSA-N

SMILES:

O=CCCc1ccc2c(c1)OCC2(C)C

Complexity:

235

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.115g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.269g/mol

Monoisotopic Mass:

204.115g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5