5-(Bromomethyl)-2,1,3-benzoxadiazole
Properties
- Molecular formula
- C7H5BrN2O
- Molar mass
- 213.03 g/mol
- Exact mass
- 211.9585 Da
- logP
- 2.12Crippen estimate
- Polar surface area
- 38.9 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
Danger
- H314 Causes severe skin burns and eye damage50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501
Identifiers
CAS number
32863-31-3SMILES
C1=CC2=NON=C2C=C1CBrInChIKey
BUJFLTNYWUEROF-UHFFFAOYSA-NInChI
InChI=1S/C7H5BrN2O/c8-4-5-1-2-6-7(3-5)10-11-9-6/h1-3H,4H2Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 5-(Bromomethyl)-2,1,3-benzoxadiazole
Similar compounds
5-Bromo-2,1,3-benzoxadiazole51376-06-850 % similar
1,4-Bis(bromomethyl)benzene623-24-544 % similar
1,3-Bis(bromomethyl)benzene626-15-343 % similar
2,1,3-Benzoxadiazole273-09-641 % similar
4,4'-Bis(bromomethyl)-2,2'-bipyridine134457-14-041 % similar
3,4-Dichlorobenzyl bromide18880-04-141 % similar
3,4-Difluorobenzyl bromide85118-01-041 % similar
2-(Bromomethyl)naphthalene939-26-441 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.