1-BENZYL 2-METHYL (S)-(-)-1,2-AZIRIDINEDICARBOXYLATE
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1-BENZYL 2-METHYL (S)-(-)-1,2-AZIRIDINEDICARBOXYLATE
structure -
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CAS No:
104597-98-0
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Formula:
C12H13NO4
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Chemical Name:
1-BENZYL 2-METHYL (S)-(-)-1,2-AZIRIDINEDICARBOXYLATE
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Synonyms:
1-BENZYL 2-METHYL (S)-(-)-1,2-AZIRIDINEDICARBOXYLATE;(S)-1-benzyl 2-methyl aziridine-1,2-dicarboxylate;Methyl (S)-(-)-N-Z-aziridine-2-carboxylate;Methyl (S)-(-)-N-benzyloxycarbonylaziridine-2-carboxylate;(S)-N-[(Benzyloxy)carbonyl]aziridine-2-carboxylic Acid Methyl Ester;Methyl (S)-(-)-N-Z-aziridine-2-carboxylate 96%;1-benzyl 2-methyl (S)-aziridine-1,2-dicarboxylate
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CAS No:
Characteristics
55.61000
0.98
1.19 g/mL at 25 °C(lit.)
160-165 °C2 mm Hg(lit.)
110 °C
n 20/D 1.519(lit.)
Safety Information
NONH for all modes of transport
3
R43;R36/37/38
S26-S37-S39
Xi
|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.
1-BENZYL 2-METHYL (S)-(-)-1,2-AZIRIDINEDICARBOXYLATE Use and Manufacturing
Aziridine carboxylic acid ester derivative used for the synthetic application of chiral aziridine via esterification.
Computed Properties
Molecular Weight:235.24
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:235.08445790
Monoisotopic Mass:235.08445790
Topological Polar Surface Area:55.6
Heavy Atom Count:17
Complexity:299
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-BENZYL 2-METHYL (S)-(-)-1,2-AZIRIDINEDICARBOXYLATE
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