5-Bromo-2-pyridinemethanamine

C₆H₇BrN₂CAS 173999-23-0187.04 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₇BrN₂
Molar mass: 187.04 g/mol
Exact mass: 185.9793 Da
logP: 1.30Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H318 Causes serious eye damage50% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

173999-23-0

SMILES

NCc1ccc(Br)cn1

InChIKey

AUIXMWKVLPXKGC-UHFFFAOYSA-N

InChI

InChI=1S/C6H7BrN2/c7-5-1-2-6(3-8)9-4-5/h1-2,4H,3,8H2

Weigh it out

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

Names and synonyms

5 names

2-Pyridinemethanamine, 5-bromo-
[(5-Bromopyridin-2-yl)methyl]amine
(5-Bromopyridin-2-yl)methanamine
[(5-Bromo-2-pyridyl)methyl]amine
1-(5-Bromopyridin-2-yl)methanamine

Work with 5-Bromo-2-pyridinemethanamine

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

2-Hydroxymethyl-5-bromopyridine88139-91-759 % similar 5-Bromo-2-pyridineacetonitrile312325-72-753 % similar C-(4-Bromo-pyridin-2-yl)-methylamine865156-50-952 % similar 2-(5-Bromopyridin-2-yl)acetic acid192642-85-649 % similar 5-(Trifluoromethyl)-2-pyridinemethanamine164341-39-348 % similar 5,5'-Dibromo-2,2'-bipyridine15862-18-748 % similar 4-Bromobenzenemethanamine3959-07-746 % similar 2,5-Dibromopyridine624-28-246 % similar

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

Same formula

6-Bromo-N-methylpyridin-3-amine1022641-52-6 4-Amino-5-bromo-2-methylpyridine10460-50-1 2-Amino-3-bromo-6-methylpyridine126325-46-0 6-Bromo-2-methyl-3-pyridinamine126325-47-1 4-Bromo-2-methyl-3-pyridinamine126325-48-2 2-Bromo-4-methyl-3-pyridinamine126325-50-6 2-Bromo-6-methyl-3-pyridinamine126325-53-9 6-Bromo-4-methylpyridin-3-amine156118-16-0

Elsewhere

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