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1628502-01-1

1628502-01-1 Structure

1628502-01-1 Structure
IdentificationBack Directory
[Name]

3-Azaspiro[5.5]undec-8-ene-3-carboxylic acid, 9-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester
[CAS]

1628502-01-1
[Synonyms]

tert-Butyl 9-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-azaspiro[5.5]undec-8-ene-3-carboxylate
3-Azaspiro[5.5]undec-8-ene-3-carboxylic acid, 9-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester
3-Azaspiro[5.5]undec-8-ene-3-carboxylic acid, 9-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester (ACI)
[Molecular Formula]

C21H36BNO4
[MOL File]

1628502-01-1.mol
[Molecular Weight]

377.33
Chemical PropertiesBack Directory
[Boiling point ]

429.5±55.0 °C(Predicted)
[density ]

1.06±0.1 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[pka]

-0.70±0.40(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C21H36BNO4/c1-18(2,3)25-17(24)23-14-12-21(13-15-23)10-8-16(9-11-21)22-26-19(4,5)20(6,7)27-22/h8H,9-15H2,1-7H3
[InChIKey]

ZMSGRBDTTJUVSM-UHFFFAOYSA-N
[SMILES]

C1C2(CCC(B3OC(C)(C)C(C)(C)O3)=CC2)CCN(C(OC(C)(C)C)=O)C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

3-Azaspiro[5.5]undec-8-ene-3-carboxylic acid, 9-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester(1628502-01-1)1HNMR
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