Name: Name:1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3,3-difluoropiperidine-4-carboxylic acid
Brand: Angene
SKU: AG01EKRR
Rating: 90 (10 reviews)

1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3,3-difluoropiperidine-4-carboxylic acid

CAS No.:

2094456-40-1

Catalog Number:

AG01EKRR

Molecular Formula:

C21H19F2NO4

Molecular Weight:

387.3767

Catalog Number:

AG01EKRR

Chemical Name:

1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3,3-difluoropiperidine-4-carboxylic acid

CAS Number:

2094456-40-1

Molecular Formula:

C21H19F2NO4

Molecular Weight:

387.3767

MDL Number:

MFCD31559879

IUPAC Name:

1-(9H-fluoren-9-ylmethoxycarbonyl)-3,3-difluoropiperidine-4-carboxylic acid

InChI:

InChI=1S/C21H19F2NO4/c22-21(23)12-24(10-9-18(21)19(25)26)20(27)28-11-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17-18H,9-12H2,(H,25,26)

InChI Key:

VLSBUDCUZNUOQJ-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCN(CC1(F)F)C(=O)OCC1c2ccccc2c2c1cccc2

Complexity:

591

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

387.128g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

387.383g/mol

Monoisotopic Mass:

387.128g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6