Benzenebutanoic acid, b-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(phenylmethoxy)-, (bS)-
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Benzenebutanoic acid, b-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(phenylmethoxy)-, (bS)-

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Category
BOC-Amino Acids
Catalog number
BAT-014144
CAS number
126825-16-9
Molecular Formula
C22H27NO5
Molecular Weight
385.45
Benzenebutanoic acid, b-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(phenylmethoxy)-, (bS)-
IUPAC Name
(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-phenylmethoxyphenyl)butanoic acid
Synonyms
Boc-L-beta-homotyrosine(OBzl); Boc-O-benzyl-L-β-homotyrosine; Boc-L-β-HomoTyr(Bzl)-OH
Appearance
White Powder
Purity
≥ 99% by HPLC
Density
1.311±0.06 g/cm3(Predicted)
Boiling Point
462.3±35.0 °C(Predicted)
Storage
Store at 2-8 °C
InChI
InChI=1S/C22H27NO5/c1-22(2,3)28-21(26)23-18(14-20(24)25)13-16-9-11-19(12-10-16)27-15-17-7-5-4-6-8-17/h4-12,18H,13-15H2,1-3H3,(H,23,26)(H,24,25)/t18-/m0/s1
InChI Key
HTZSKDKNNZPVMJ-SFHVURJKSA-N
Canonical SMILES
CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)CC(=O)O
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