1,1-Dimethylethyl 2-bromopropanoate
Properties
- Molecular formula
- C7H13BrO2
- Molar mass
- 209.08 g/mol
- Exact mass
- 208.0099 Da
- Boiling point
- 51–52 °C (at 10 Torr)
- logP
- 2.11Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation41.7% of notifiers
- H335 May cause respiratory irritation25% of notifiers
Aggregated from 12 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
39149-80-9SMILES
CC(Br)C(=O)OC(C)(C)CInChIKey
CVAWKJKISIPBOD-UHFFFAOYSA-NInChI
InChI=1S/C7H13BrO2/c1-5(8)6(9)10-7(2,3)4/h5H,1-4H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Propanoic acid, 2-bromo-, 1,1-dimethylethyl ester
- Propionic acid, 2-bromo-, tert-butyl ester
- tert-Butyl 2-bromopropionate
- tert-Butyl α-bromopropionate
- tert-Butyl 2-bromopropanoate
- 1,1-Dimethylethyl 2-bromopropionate
- 2-Bromopropionic acid tert-butyl ester
Work with 1,1-Dimethylethyl 2-bromopropanoate
Similar compounds
Methyl 2-bromopropanoate5445-17-054 % similar
L-Valine tert-butyl ester13211-31-950 % similar
tert-Butyl alaninate hydrochloride13404-22-348 % similar
D-Alanine tert-butyl ester hydrochloride59531-86-148 % similar
Ethyl 2-bromopropionate535-11-548 % similar
N-Me-ala-otbu hcl103614-40-046 % similar
tert-Butyl (2S)-2-amino-3-methylbutanoate hydrochloride13518-40-646 % similar
O-(1,1-Dimethylethyl)-L-threonine 1,1-dimethylethyl ester5854-78-446 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds