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N-(tert-Butoxycarbonyl)aniline-[13C6]

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General Information
Catalog: BLP-011972
CAS: 176850-21-8
Molecular Formula: C5[13C]6H15NO2
Molecular Weight: 199.19

Chemical Structure

Synonyms	N-(tert-Butoxycarbonyl)aniline-13C6
IUPAC Name	tert-butyl N-((1,2,3,4,5,6-13C6)cyclohexatrienyl)carbamate
Related CAS	3422-01-3 (unlabelled)
Isomeric SMILES	CC(C)(C)OC(=O)N[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1
Canonical SMILES	CC(C)(C)OC(=O)NC1=CC=CC=C1
InChI	InChI=1S/C11H15NO2/c1-11(2,3)14-10(13)12-9-7-5-4-6-8-9/h4-8H,1-3H3,(H,12,13)/i4+1,5+1,6+1,7+1,8+1,9+1
InChI Key	KZZHPWMVEVZEFG-VFESMUGCSA-N
Melting Point	135-137°C
Density	1.1±0.1 g/cm3
Solubility	Soluble in DMSO, Methanol
Appearance	White Solid
Application	Protected, labelled Aniline.
Storage	Store at -20°C