4-Bromo-2-methoxybenzenamine

C7H8BrNOCAS 59557-91-4202.05 g/mol

Open in Covalent MOL file
OBrH2N
Aryl halideEtherPrimary amine

Properties

Molecular formula
C7H8BrNO
Molar mass
202.05 g/mol
Exact mass
200.9789 Da
Melting point
60–61 °C
logP
2.04Crippen estimate
Polar surface area
35.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, P391, P501

Identifiers

CAS number
59557-91-4
SMILES
COc1cc(Br)ccc1N
InChIKey
WRFYIYOXJWKONR-UHFFFAOYSA-N
InChI
InChI=1S/C7H8BrNO/c1-10-7-4-5(8)2-3-6(7)9/h2-4H,9H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Benzenamine, 4-bromo-2-methoxy-
  • o-Anisidine, 4-bromo-
  • 4-Bromo-o-anisidine
  • 2-Amino-5-bromoanisole
  • 4-Bromo-2-methoxyaniline
  • 2-Methoxy-4-bromoaniline
  • 4-Bromo-2-methoxyphenylamine

Work with 4-Bromo-2-methoxybenzenamine

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

5-Bromo-2-methoxyaniline6358-77-671 % similar Bromoveratrole2859-78-167 % similar O-Dianisidine119-90-461 % similar 2,4-Dimethoxyaniline2735-04-859 % similar 4-Bromo-1-fluoro-2-methoxybenzene103291-07-258 % similar 5-Bromo-2-chloroanisole16817-43-958 % similar 4-Bromo-2-methoxyphenol7368-78-758 % similar 4-Bromo-1-iodo-2-methoxybenzene791642-68-758 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-3-methoxy-2-methylpyridine1150617-80-3 2-Amino-6-bromoanisole116557-46-1 5-Bromo-2-methoxy-6-picoline126717-59-7 5-Bromo-2-methoxy-4-methylpyridine164513-39-7 4-Bromo-3-methoxyaniline19056-40-7 3-Bromo-4-methoxyaniline19056-41-8 5-Bromo-2-ethoxypyridine55849-30-4 3-Bromo-2-ethoxypyridine57883-25-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook