BOC-D-3-BENZOTHIENYLALANINE
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BOC-D-3-BENZOTHIENYLALANINE
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CAS No:
111082-76-9
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Formula:
C16H19NO4S
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Chemical Name:
BOC-D-3-BENZOTHIENYLALANINE
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Synonyms:
N-ALPHA-T-BUTOXYCARBONYL-3-(3-BENZOTHIENYL)-D-ALANINE;RARECHEM BK PT 0207;boc-β-(3-benzothienyl)-d-ala-oh;3-Benzo[b]thiophen-3-yl-D-alanine, N-BOC protected;(R)-3-(benzo[b]thiophen-3-yl)-2-(tert-butoxycarbonylamino)propanoic acid;BOC-3-(3-BENZOTHIENYL)-D-ALA-OH;NALPHA-tert-Butoxycarbonyl-3-(3-benzothienyl)-D-alanine;(2R)-3-(3-benzylthiophen-2-yl)-2-{[(tert-butoxy)carbonyl]aMino}propanoic acid
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CAS No:
Characteristics
104
3.5
1.274±0.06 g/cm3(Predicted)
63-67 °C(Solv: ethanol (64-17-5))
514.1±45.0 °C(Predicted)
264.7±28.7 °C
1.603
Store at 0-5°C
2.15E-11mmHg at 25°C
Computed Properties
Molecular Weight:321.4
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:321.10347926
Monoisotopic Mass:321.10347926
Topological Polar Surface Area:104
Heavy Atom Count:22
Complexity:421
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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