(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid
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![(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c4dc716984be4a2ab5c7dade6f49fce1.png "(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid")
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid
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CAS No:
155905-76-3
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Formula:
C12H21NO4
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Chemical Name:
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid
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Synonyms:
155905-76-3;(S)-1-(BOC)AZEPANE-2-CARBOXYLIC ACID;(S)-1-Boc-azepane-2-carboxylic acid;(2s)-1-[(tert-butoxy)carbonyl]azepane-2-carboxylic acid;(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid;SCHEMBL5898691;(S)-AZEPANE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER;AMY34388;ZINC1420623;MFCD04973145;AS-50471;CS-0053453;Q-4350;(S)-(-)-1-(tert-Butoxycarbonyl)-2-azepanecarboxylic acid;(S)-N-ALPHA-T-BUTYLOXYCARBONYL-AZEPIN-2-CARBOXYLIC ACID;(S)-Perhydro-azepine-1,2-dicarboxylic acid 1-tert-butyl ester;(2S)-Hexahydro-1H-azepine-1,2alpha-dicarboxylic acid 1-tert-butyl ester
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CAS No:
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]azepane-2-carboxylic acid Basic Attributes
243.30 g/mol
243.14705815 g/mol
Computed Properties
Molecular Weight:243.30
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:243.14705815
Monoisotopic Mass:243.14705815
Topological Polar Surface Area:66.8
Heavy Atom Count:17
Complexity:295
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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