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Benzyl bromoacetate · CAS 5437-45-6 · C9H9BrO2. UNII 64U2RK18D3.
| CAS Registry Number | 5437-45-6 |
|---|---|
| PubChem CID | 62576 |
| Molecular formula | C9H9BrO2 |
| IUPAC name | benzyl 2-bromoacetate |
| UNII (FDA) | 64U2RK18D3 |
| Molecular Weight | 229.07 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 227.97859 |
| Monoisotopic Mass | 227.97859 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Regulatory & Food Contact | FDA Inventory of Food Contact Substances Listed in 21 CFR: FCS |
|---|
| Reported hazard statements | H315 (100%), H319 (100%), H335 (96.2%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Benzyl 2-bromoacetate; Benzyl bromoacetate; 5437-45-6; Bromoacetic acid benzyl ester; Acetic acid, bromo-, phenylmethyl ester; Merbac 35; DTXSID4040343; 64U2RK18D3; NSC-16114; NSC-23980; DTXCID2020343; RefChem:1079468; 226-611-4; MFCD00000190; 2-Bromoacetic Acid Phenylmethyl Ester; Acetic acid, bromo-, benzyl ester
CAS 5437-45-6; molecular formula C9H9BrO2; molecular weight — g/mol.
Benzyl 2-bromoacetate, Benzyl bromoacetate, 5437-45-6, Bromoacetic acid benzyl ester, Acetic acid, bromo-, phenylmethyl ester, Merbac 35.
Documented regulatory listings: FDA Inventory of Food Contact Substances Listed in 21 CFR: FCS.
Hazard statements reported: H315, H319, H335.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.