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452339-72-9

452339-72-9 Structure

452339-72-9 Structure
IdentificationBack Directory
[Name]

CarbaMic acid, [(2R)-2-(2,2-diMethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethyl]-, 1,1-diMethylethyl ester
[CAS]

452339-72-9
[Synonyms]

BNKY020-VT03
tert-butyl (2R)-2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-h...
tert-butyl (2R)-2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethylcarbamate
(R)-tert-butyl (2-(2,2-dimethyl-4H-benzo[d][1,3]dioxin-6-yl)-2-hydroxyethyl)carbamate
CarbaMic acid, [(2R)-2-(2,2-diMethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethyl]-, 1,1-diMethylethyl ester
Carbamic acid, N-[(2R)-2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethyl]-, 1,1-dimethylethyl ester
Carbamic acid, [(2R)-2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethyl]-, 1,1-dimethylethyl ester (9CI)
[EINECS(EC#)]

629-202-2
[Molecular Formula]

C17H25NO5
[MDL Number]

MFCD28347558
[MOL File]

452339-72-9.mol
[Molecular Weight]

323.38
Chemical PropertiesBack Directory
[Boiling point ]

488.6±45.0 °C(Predicted)
[density ]

1.143±0.06 g/cm3(Predicted)
[pka]

12.17±0.46(Predicted)
[InChI]

InChI=1S/C17H25NO5/c1-16(2,3)23-15(20)18-9-13(19)11-6-7-14-12(8-11)10-21-17(4,5)22-14/h6-8,13,19H,9-10H2,1-5H3,(H,18,20)/t13-/m0/s1
[InChIKey]

XBKHRWZUBFHWJU-ZDUSSCGKSA-N
[SMILES]

C(OC(C)(C)C)(=O)NC[C@@H](C1=CC=C2OC(C)(C)OCC2=C1)O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
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