Name: Name:2,2-difluoro-octahydro-1H-indene-3a-carboxylic acid
Brand: Angene
SKU: AG01EL15
Rating: 90 (10 reviews)

2,2-difluoro-octahydro-1H-indene-3a-carboxylic acid

CAS No.:

1780300-27-7

Catalog Number:

AG01EL15

Molecular Formula:

C10H14F2O2

Molecular Weight:

204.2138

Catalog Number:

AG01EL15

Chemical Name:

2,2-difluoro-octahydro-1H-indene-3a-carboxylic acid

CAS Number:

1780300-27-7

Molecular Formula:

C10H14F2O2

Molecular Weight:

204.2138

MDL Number:

MFCD31666761

IUPAC Name:

2,2-difluoro-3,4,5,6,7,7a-hexahydro-1H-indene-3a-carboxylic acid

InChI:

InChI=1S/C10H14F2O2/c11-10(12)5-7-3-1-2-4-9(7,6-10)8(13)14/h7H,1-6H2,(H,13,14)

InChI Key:

DDOHHAIDKXLPNH-UHFFFAOYSA-N

SMILES:

OC(=O)C12CCCCC2CC(C1)(F)F

Complexity:

265

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.217g/mol

Monoisotopic Mass:

204.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8