3,5-Dibromoaniline

C₆H₅Br₂NCAS 626-40-4250.92 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₅Br₂N
Molar mass: 250.92 g/mol
Exact mass: 248.8789 Da
logP: 2.79Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

626-40-4

SMILES

C1=C(C=C(C=C1Br)Br)N

InChIKey

RVNUUWJGSOHMRR-UHFFFAOYSA-N

InChI

InChI=1S/C6H5Br2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 3,5-Dibromoaniline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Bromo-5-fluoroaniline134168-97-164 % similar 3-Bromo-5-methylbenzenamine74586-53-164 % similar 1,3,5-Tribromobenzene626-39-160 % similar 3-Bromo-5-(trifluoromethyl)aniline54962-75-356 % similar 3-Bromoaniline591-19-555 % similar 3-Amino-5-bromopyridine13535-01-852 % similar 4-Bromoaniline106-40-150 % similar 3,3',5,5'-Tetrabromobiphenyl16400-50-350 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,3-Dibromo-6-methylpyridine261373-04-0 2,3-Dibromo-5-methylpyridine29232-39-1 2,5-Dibromo-3-methylpyridine3430-18-0 3,5-Dibromo-4-methylpyridine3430-23-7 2,5-Dibromo-4-methylpyridine3430-26-0 2,5-Dibromoaniline3638-73-1 3,6-Dibromo-2-methylpyridine39919-65-8 2,6-Dibromoaniline608-30-0

Elsewhere

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