Name: Name:Benzenepentanoic acid, a-[[(1,1-dimethylethoxy)carbonyl]amino]-, (S)-
Brand: Angene
SKU: AG00IK5D
Rating: 90 (10 reviews)

Benzenepentanoic acid, a-[[(1,1-dimethylethoxy)carbonyl]amino]-, (S)-

CAS No.:

98628-27-4

Catalog Number:

AG00IK5D

Molecular Formula:

C16H23NO4

Molecular Weight:

293.3581

Catalog Number:

AG00IK5D

Chemical Name:

Benzenepentanoic acid, a-[[(1,1-dimethylethoxy)carbonyl]amino]-, (S)-

CAS Number:

98628-27-4

Molecular Formula:

C16H23NO4

Molecular Weight:

293.3581

MDL Number:

MFCD04117840

IUPAC Name:

(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpentanoic acid

InChI:

InChI=1S/C16H23NO4/c1-16(2,3)21-15(20)17-13(14(18)19)11-7-10-12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3,(H,17,20)(H,18,19)/t13-/m0/s1

InChI Key:

AIFKBFKJMQTYAM-ZDUSSCGKSA-N

SMILES:

OC(=O)[C@@H](NC(=O)OC(C)(C)C)CCCc1ccccc1

Complexity:

343

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

293.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

293.363g/mol

Monoisotopic Mass:

293.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2