(3S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinecarboxylicacid
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(3S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinecarboxylicacid
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CAS No:
140148-70-5
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Formula:
C10H17NO4
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Chemical Name:
(3S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinecarboxylicacid
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Synonyms:
(S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinecarboxylic acid;(3S)-Boc-β-Pro-OH;1,3-Pyrrolidinedicarboxylic acid, 1-(1,1-dimethylethyl) ester, (3S)-;(3S)-1-Boc-3-pyrrolidinecarboxylic acid;N-Boc-L-beta-proline;(S)-3-Carboxypyrrolidine-1-carboxylic acidtert-butyl ester;BOC-L-B-PROLINE;BOC-(3S)-1-PYRROLIDINE-3-CARBOXYLIC ACID
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CAS No:
(3S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinecarboxylicacid Basic Attributes
215.25
215.11575802 g/mol
2933990090
Characteristics
66.84000
1.26590
1.201±0.06 g/cm3
140-145°C
337.2±35.0 °C(Predicted)
157.7ºC
1.503
Soluble in water (slightly).
Store at 0-5ºC
0mmHg at 25°C
4.47±0.20
Safety Information
UN 3077 9 / PGIII
3
41-50
26-39-61
Xi,N
|Danger|H318 (97.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P273, P280, P305+P351+P338, P310, P391, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:215.25
XLogP3:0.8
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
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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