Name: Name:4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,4-oxazepane-6-carboxylic acid
Brand: Angene
SKU: AG01BKBQ
Rating: 90 (10 reviews)

4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,4-oxazepane-6-carboxylic acid

CAS No.:

1936071-00-9

Catalog Number:

AG01BKBQ

Molecular Formula:

C21H21NO5

Molecular Weight:

367.3951

Catalog Number:

AG01BKBQ

Chemical Name:

4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,4-oxazepane-6-carboxylic acid

CAS Number:

1936071-00-9

Molecular Formula:

C21H21NO5

Molecular Weight:

367.3951

MDL Number:

MFCD31559777

IUPAC Name:

4-(9H-fluoren-9-ylmethoxycarbonyl)-1,4-oxazepane-6-carboxylic acid

InChI:

InChI=1S/C21H21NO5/c23-20(24)14-11-22(9-10-26-12-14)21(25)27-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19H,9-13H2,(H,23,24)

InChI Key:

LTFXJQSQUFXUSI-UHFFFAOYSA-N

SMILES:

OC(=O)C1COCCN(C1)C(=O)OCC1c2ccccc2c2c1cccc2

Complexity:

531

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

367.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

367.401g/mol

Monoisotopic Mass:

367.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4