N-Boc-D-proline
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N-Boc-D-proline
structure -
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CAS No:
37784-17-1
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Formula:
C10H17NO4
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Chemical Name:
N-Boc-D-proline
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Synonyms:
(R)-PYRROLIDINE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER;T-BUTYLOXYCARBONYL-D-PROLINE;N-ALPHA-TERT-BUTYLOXYCARBONYL-D-PROLINE;N-ALPHA-T-BUTYLOXYCARBONYL-D-PROLINE;N-ALPHA-T-BUTYLOXYCARBONYL-D-PYRROLIDINE-2-CARBOXYLIC ACID;N-ALPHA-T-BOC-D-PROLINE;BOC-(R)-PYRROLIDINE-5-CARBOXYLIC ACID;BOC-D-PROLINE
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CAS No:
N-Boc-D-proline Basic Attributes
215.25
215.115753
479316
1533716-785-6
334360|164660|108689
White to off-white
2933 99 80
Characteristics
66.8
1.5
White to off-white Crystalline Powder or Crystals
1.1835 (rough estimate)
134-137 °C (lit.)
355.52°C (rough estimate)
157.7±25.9 °C
60 ° (C=2, AcOH)
−20°C
60 º (c=2, acetic acid)
4.01±0.20(Predicted)
2-8°C
Safety Information
NONH for all modes of transport
3
24/25
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
N-Boc-D-proline Use and Manufacturing
tert-Butoxycarbonyl-D-proline is Boc protected D-proline (P755990). It is used to prepare trichostatin A and trapoxin B analogs as histone deacetylase inhibitors. It is also used to prepare potent and selective nonpeptide inhibitors of caspases 3 and 7.
Computed Properties
Molecular Weight:215.25
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:215.11575802
Monoisotopic Mass:215.11575802
Topological Polar Surface Area:66.8
Heavy Atom Count:15
Complexity:269
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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