Name: Name:3-Furancarboxylic acid, tetrahydro-4-[[(1R)-1-phenylethyl]amino]-, methyl ester, (3S,4S)-rel-
Brand: Angene
SKU: AG002A6X
Rating: 90 (10 reviews)

3-Furancarboxylic acid, tetrahydro-4-[[(1R)-1-phenylethyl]amino]-, methyl ester, (3S,4S)-rel-

CAS No.:

2055840-97-4

Catalog Number:

AG002A6X

Molecular Formula:

C14H19NO3

Molecular Weight:

249.3056

Catalog Number:

AG002A6X

Chemical Name:

3-Furancarboxylic acid, tetrahydro-4-[[(1R)-1-phenylethyl]amino]-, methyl ester, (3S,4S)-rel-

CAS Number:

2055840-97-4

Molecular Formula:

C14H19NO3

Molecular Weight:

249.3056

MDL Number:

MFCD30531335

IUPAC Name:

methyl (3S,4S)-4-[[(1R)-1-phenylethyl]amino]oxolane-3-carboxylate

InChI:

InChI=1S/C14H19NO3/c1-10(11-6-4-3-5-7-11)15-13-9-18-8-12(13)14(16)17-2/h3-7,10,12-13,15H,8-9H2,1-2H3/t10-,12-,13-/m1/s1

InChI Key:

VYWULYQHYAJIJY-RAIGVLPGSA-N

SMILES:

COC(=O)[C@@H]1COC[C@H]1N[C@@H](c1ccccc1)C

Complexity:

276

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.31g/mol

Monoisotopic Mass:

249.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

47.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8