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4-Nitrophenol-1,2,6-[13C3]

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General Information
Catalog: BLP-005772
CAS: 93628-02-5
Molecular Formula: [13C]3C3H5NO3
Molecular Weight: 142.09

Chemical Structure

Description	4-Nitrophenol-1,2,6-[13C3] is an isotope analogue of 4-Nitrophenol, which is a useful reactant in the manufacturing of pharmaceuticals, fungicides, dyes.
IUPAC Name	4-nitro(1,2,6-13C3)cyclohexa-1,3,5-trien-1-ol
Related CAS	100-02-7 (unlabelled)
Isomeric SMILES	C1=[13CH][13C](=[13CH]C=C1[N+](=O)[O-])O
Canonical SMILES	C1=CC(=CC=C1[N+](=O)[O-])O
InChI	InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H/i3+1,4+1,6+1
InChI Key	BTJIUGUIPKRLHP-JYLXJXPXSA-N
Melting Point	113-115°C
Purity	98% by CP; 99% atom 13C
Appearance	Solid