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alpha-Methylbenzyl isocyanate (C9H9NO)

Looking for routes to alpha-Methylbenzyl isocyanate? alpha-Methylbenzyl isocyanate presents a C9 framework, aromatic rings. Use the planner with prefilled SMILES, or copy CC(N=C=O)c1ccccc1 (CAS 1837-73-6).

Target
alpha-Methylbenzyl isocyanate
CAS
1837-73-6
Formula
C9H9NO
Approx. MW
147.18
SMILES
CC(N=C=O)c1ccccc1
PubChem CID
85760
Approx. carbons
C9

alpha-Methylbenzyl isocyanate structure

Properties

IUPAC name
1-isocyanatoethylbenzene
Common names
1837-73-6; alpha-Methylbenzyl isocyanate; RefChem:915554; (1-Isocyanatoethyl)benzene; 1-isocyanatoethylbenzene; Benzene, (1-isocyanatoethyl)-; (1-Isocyanato-ethyl)-benzene; R-(+)-alpha-Methylbenzyl isocyanate; (s)-(1-isocyanatoethyl)benzene; Benzene,(1-isocyanatoethyl)-
Molecular weight
147.17
Exact mass
147.07
InChIKey
JJSCUXAFAJEQGB-UHFFFAOYSA-N

View on PubChem

alpha-Methylbenzyl isocyanate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of alpha-Methylbenzyl isocyanate?

alpha-Methylbenzyl isocyanate has molecular formula C9H9NO. Molecular weight about 147.18 g·mol⁻¹.

What is the CAS number of alpha-Methylbenzyl isocyanate?

The CAS Registry Number for alpha-Methylbenzyl isocyanate is 1837-73-6.

Run AI retrosynthesis for alpha-Methylbenzyl isocyanate Target catalog AI tools overview

One click loads alpha-Methylbenzyl isocyanate into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

4-Hydroxy-2-methylindole4-Methoxyindole(2-Bromopropyl)benzene(3-Bromopropoxy)benzene(Chloromethyl)dimethylphenylsilane1-(3-(trifluoromethoxy)phenyl)ethanone

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References & tools