Name: Name:7-[(dimethylamino)methyl]-2,2-difluoro-1,3-dioxaindane-4-carbaldehyde
Brand: Angene
SKU: AG01E8NH
Rating: 90 (10 reviews)

7-[(dimethylamino)methyl]-2,2-difluoro-1,3-dioxaindane-4-carbaldehyde

CAS No.:

2095409-86-0

Catalog Number:

AG01E8NH

Molecular Formula:

C11H11F2NO3

Molecular Weight:

243.2067

Catalog Number:

AG01E8NH

Chemical Name:

7-[(dimethylamino)methyl]-2,2-difluoro-1,3-dioxaindane-4-carbaldehyde

CAS Number:

2095409-86-0

Molecular Formula:

C11H11F2NO3

Molecular Weight:

243.2067

MDL Number:

MFCD30730452

IUPAC Name:

7-[(dimethylamino)methyl]-2,2-difluoro-1,3-benzodioxole-4-carbaldehyde

InChI:

InChI=1S/C11H11F2NO3/c1-14(2)5-7-3-4-8(6-15)10-9(7)16-11(12,13)17-10/h3-4,6H,5H2,1-2H3

InChI Key:

OPSYXYGFVCPDNR-UHFFFAOYSA-N

SMILES:

O=Cc1ccc(c2c1OC(O2)(F)F)CN(C)C

Complexity:

298

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.21g/mol

Monoisotopic Mass:

243.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8