1-(TERT-BUTOXYCARBONYL)-5-METHOXY-1H-INDOL-2-YLBORONICACID
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1-(TERT-BUTOXYCARBONYL)-5-METHOXY-1H-INDOL-2-YLBORONICACID
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CAS No:
290331-71-4
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Formula:
C14H18BNO5
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Chemical Name:
1-(TERT-BUTOXYCARBONYL)-5-METHOXY-1H-INDOL-2-YLBORONICACID
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Synonyms:
N-Boc-5-methoxy-2-indolylboronic acid;5-methoxy-N-Boc-1H-indol-2-ylboronic acid;1-(tert-Butoxycarbonyl)-5-methoxy-1H-indol-2-ylboronic acid , May contain varying amounts of anhydride, 97%;1-(tert-Butoxycarbonyl)-5-Methoxy-1H-indol-2-ylboronic acid, 97%, Variable anhydride content;1-(tert-Butoxycarbonyl)-5-methoxy-1H-indole-2-boronic acid, tert-Butyl 2-borono-5-methoxy-1H-indole-1-carboxylate;1-BOC-5-METHOXY-1H-INDOLE-2-BORONIC ACID;1-BOC-5-METHOXY-2-INDOLEBORONIC ACID;1-BOC-5-METHOXYINDOLE-2-BORONIC ACID
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CAS No:
1-(TERT-BUTOXYCARBONYL)-5-METHOXY-1H-INDOL-2-YLBORONICACID Basic Attributes
291.11
291.1278028
DTXSID60383346
2933990090
Characteristics
80.92000
1.11290
1.19±0.1 g/cm3
98 °C
475.9±55.0 °C(Predicted)
1.535
7.3E-10mmHg at 25°C
8.00±0.30
Safety Information
3
Xi
|Warning|H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]|P260, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P314, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:291.11
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:291.1278028
Monoisotopic Mass:291.1278028
Topological Polar Surface Area:80.9
Heavy Atom Count:21
Complexity:384
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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