5-Bromo-2-(2-hydroxyethoxy)-N-methylbenzene-1-carboximidic acid

HCID 45015

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Basic information

CAS: 63887-02-5
Standard SMILES: CNC(=O)c1cc(Br)ccc1OCCO
InChIKey: SOBYBGYFETUFEY-UHFFFAOYSA-N
Molecular formula: C10H12BrNO3
Average molar mass: 274.11 g/mol
Monoisotopic mass: 273.00006

Names & identifiers

Preferred name: 5-Bromo-2-(2-hydroxyethoxy)-N-methylbenzene-1-carboximidic acid
IUPAC: 5-bromo-2-(2-hydroxyethoxy)-N-methylbenzamide
English name: 5-Bromo-2-(2-hydroxyethoxy)-N-methylbenzamide
Molecular formula: C10H12BrNO3
Molecular weight: 274.11

Names & synonyms

63887-02-5DTXSID109807835-Bromo-2-(2-hydroxyethoxy)-N-methylbenzene-1-carboximidic acidRefChem:1072705DTXCID3014080565-bromo-2-(2-hydroxyethoxy)-N-methylbenzamideBRN 31324285-Bromo-2-(beta-hydroxyethoxy)-N-methylbenzamideBENZAMIDE, 5-BROMO-2-(beta-HYDROXYETHOXY)-N-METHYL-DB-317219Benzamide, 5-bromo-2-(2-hydroxyethoxy)-N-methyl-

Database identifiers

CAS: 63887-02-5
PubChem CID: 45015
DTXSID: DTXSID10980783
Nikkaji: J149.042G

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 58.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 15
Formal charge: 0
Complexity: 213

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