Registration Dossier
Registration Dossier
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EC number: 481-150-8 | CAS number: 500011-86-9
Reference substances
- IUPAC name:
- 3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxylic acid
Inventory
- EC number:
- 481-150-8
- EC name:
- -
- CAS number:
- -
- CAS number:
- 500011-86-9
Synonyms
- Names:
- IN-DBC80
- Identifier:
- IUPAC name
- 3-Bromo-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxylic acid
- Identifier:
- IUPAC name
- 3-Bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxylic ac id
- Identifier:
- other: Molecular formula
- C9H5BrClN3O2
- Identifier:
- other: SMILES notation
- ClC1=C(N2N=C(Br)C=C2C(O)=O)N=CC=C1
- Identifier:
- other: Molecular formula
- Hill formula: C9H5BrClN3O2 CAS formula: C9H5BrClN3O2
- Identifier:
- other: InChl
- InChI=1S/C9H5BrClN3O2/c10-7-4-6(9(15)16)14(13-7)8-5(11)2-1-3-12-8/h1-4H,(H,15,16)
- Identifier:
- other: SMILES notation
- N1(C2=NC=CC=C2Cl)N=C(Br)C=C1C(=O)OH
- 3-bromo-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxylic acid
Molecular and structural information
- Molecular formula:
- C9H5BrClN3O2
- Molecular weight:
- ca. 302.52
- SMILES notation:
- O=C(O)c2cc(Br)nn2c1ncccc1Cl
- InChl:
- InChI=1/C9H5BrClN3O2/c10-7-4-6(9(15)16)14(13-7)8-5(11)2-1-3-12-8/h1-4H,(H,15,16)
- Structural formula:
Related substances
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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