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2-Chloro-4-nitroaniline (C6H5ClN2O2)

2-Chloro-4-nitroaniline (C6H5ClN2O2; CAS 121-87-9) is a practical retrosynthesis target. 2-Chloro-4-nitroaniline presents a C6 framework, aromatic rings, a nitro group. Open AI route search in one click below.

Target
2-Chloro-4-nitroaniline
CAS
121-87-9
Formula
C6H5ClN2O2
Approx. MW
172.57
SMILES
Nc1ccc([N+](=O)[O-])cc1Cl
PubChem CID
8492
Approx. carbons
C6

2-Chloro-4-nitroaniline structure

Properties

IUPAC name
2-chloro-4-nitroaniline
Common names
2-Chloro-4-nitroaniline; 121-87-9; Ocpna; 2-Chloro-4-nitrobenzenamine; o-Chloro-p-nitroaniline; 4-Nitro-2-chloroaniline; 1-AMINO-2-CHLORO-4-NITROBENZENE; Benzenamine, 2-chloro-4-nitro-; Aniline, 2-chloro-4-nitro-; DTXSID4021973
Molecular weight
172.57
Exact mass
172.00
InChIKey
LOCWBQIWHWIRGN-UHFFFAOYSA-N
Melting point
225 to 228 °F (NTP, 1992)

View on PubChem

2-Chloro-4-nitroaniline 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 2-Chloro-4-nitroaniline?

2-Chloro-4-nitroaniline has molecular formula C6H5ClN2O2. Molecular weight about 172.57 g·mol⁻¹.

What is the CAS number of 2-Chloro-4-nitroaniline?

The CAS Registry Number for 2-Chloro-4-nitroaniline is 121-87-9.

Run AI retrosynthesis for 2-Chloro-4-nitroaniline Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H5ClN2O2.

Related targets

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2-Chloro-3-methyl-5-nitropyridine2-Chloro-5-Nitroaniline1-Bromo-2-nitrobenzene1-Bromo-3-nitrobenzene1-Bromo-4-nitrobenzene1-Chloro-3-nitrobenzene

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References & tools