Name: Name:3-(9 H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-O-TOLYL-PROPIONIC ACID
Brand: Angene
SKU: AG00BEG3
Rating: 90 (10 reviews)

3-(9 H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-O-TOLYL-PROPIONIC ACID

CAS No.:

284492-03-1

Catalog Number:

AG00BEG3

Molecular Formula:

C25H23NO4

Molecular Weight:

401.4544

Catalog Number:

AG00BEG3

Chemical Name:

3-(9 H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-O-TOLYL-PROPIONIC ACID

CAS Number:

284492-03-1

Molecular Formula:

C25H23NO4

Molecular Weight:

401.4544

MDL Number:

MFCD02090649

IUPAC Name:

3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(2-methylphenyl)propanoic acid

InChI:

InChI=1S/C25H23NO4/c1-16-8-2-3-9-17(16)23(14-24(27)28)26-25(29)30-15-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h2-13,22-23H,14-15H2,1H3,(H,26,29)(H,27,28)

InChI Key:

WLJJHZZZEHMKOE-UHFFFAOYSA-N

SMILES:

OC(=O)CC(c1ccccc1C)NC(=O)OCC1c2ccccc2c2c1cccc2

Complexity:

586

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

401.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

401.462g/mol

Monoisotopic Mass:

401.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.4