Registration Dossier
Registration Dossier
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EC number: 430-550-0 | CAS number: 1671-49-4
Reference substances
- IUPAC name:
- 4-methanesulfonyl-1-methyl-2-nitrobenzene
Inventory
- EC number:
- 430-550-0
- EC name:
- -
- CAS number:
- -
- Description:
- 4-MESYL-2-NITROTOLUENE; NITRO METHYLSULFONYL TOLUENE; NMST
- CAS number:
- 1671-49-4
Synonyms
- Names:
- 2-Nitro-4-methylsulfonyltoluene
- 4-Mesyl-2-Nitrotoluene
- 4-mesyl-2-nitrotoluene
- Sulfone, methyl 3-nitro-p-tolyl
- methyl 4-methyl-3-nitrophenyl sulfone
- Identifier:
- IUPAC name
- 1-methyl-4-(methylsulfonyl)-2-nitrobenzene
- Identifier:
- IUPAC name
- 4-Mesyl-2-nitrotoluene
- Identifier:
- other: Molecular formula
- C8H9NO4S
- Identifier:
- other: SMILES notation
- Cc1ccc(cc1N(=O)=O)S(=O)(C)=O
- Identifier:
- other: SMILES notation
- CC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]
- Identifier:
- other: Molecular formula
- Hill formula: C8H9NO4S CAS formula: C8H9NO4S
- Identifier:
- other: InChl
- InChI=1/C8H9NO4S/c1-6-3-4-7(14(2,12)13)5-8(6)9(10)11/h3-5H,1-2H3
- Identifier:
- other: WCL product name
- NMST
- 1-methyl-4-(methylsulfonyl)-2-nitrobenzene
Molecular and structural information
- Molecular formula:
- C8H9NO4S
- Molecular weight:
- 215.23
- SMILES notation:
- Cc1ccc(cc1N(=O)=O)S(=O)(C)=O
- InChl:
- InChI=1/C8H9NO4S/c1-6-3-4-7(14(2,12)13)5-8(6)9(10)11/h3-5H,1-2H3
- Structural formula:
Related substances
- Identifier:
- CAS number
- Identity:
- 1671-49-4
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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