(S)-1-(TERT-BUTOXYCARBONYL)-2-AZETIDINEMETHANOL
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(S)-1-(TERT-BUTOXYCARBONYL)-2-AZETIDINEMETHANOL
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CAS No:
161511-85-9
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Formula:
C9H17NO3
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Chemical Name:
(S)-1-(TERT-BUTOXYCARBONYL)-2-AZETIDINEMETHANOL
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Synonyms:
TERT-BUTYL (2S)-2-(HYDROXYMETHYL)AZETIDINE-1-CARBOXYLATE;(S)-N-TERT-BUTYLOXYCARBONYL-2-AZETIDINYLMETHANOL;(S)-N-TERT-BUTOXYCARBONYL-2-AZETIDINYLMETHANOL;(S)-1-BOC-2-AZETIDINEMETHANOL;(S)-1-(TERT-BUTOXYCARBONYL)-2-AZETIDINEMETHANOL;(S)-1-(Tert-Butoxycarbon;(S)-tert-butyl 2-(hydroxymethyl)azetidine-1-carboxylate;(S)-2-Hydroxymethyl-azetidine-1-carboxylic acid tert-butyl ester
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CAS No:
(S)-1-(TERT-BUTOXYCARBONYL)-2-AZETIDINEMETHANOL Basic Attributes
187.24
187.12084340
DTXSID40441019
2933990090
Characteristics
49.77000
0.92600
1.05
270.3±13.0 °C(Predicted)
117.3ºC
-74 ° (C=1, MeOH)
0.001mmHg at 25°C
14.77±0.10
Safety Information
III
3
UN 3272 3/PG 3
2
25
45
MP8425050
T
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:187.24
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:187.12084340
Monoisotopic Mass:187.12084340
Topological Polar Surface Area:49.8
Heavy Atom Count:13
Complexity:198
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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