| CAS Number | 1135131-50-8 |
| Catalog Number | AG00HCQ5(AGN-PC-0WR1UR) |
| Chemical Name | Bromo-PEG1-CH2CO2H |
| IUPAC Name | 2-(2-bromoethoxy)acetic acid |
| InChI | InChI=1S/C4H7BrO3/c5-1-2-8-3-4(6)7/h1-3H2,(H,6,7) |
| InChI Key | GBPDANKBFPPRCR-UHFFFAOYSA-N |
| MDL Number | MFCD20637665 |
| Molecular Formula | C4H7BrO3 |
| Molecular Weight | 183.0006 |
| SMILES | BrCCOCC(=O)O |
| Synonyms | Bromo-PEG1-CH2CO2H,
1135131-50-8,
(2-bromo-ethoxy)-acetic acid,
Br-PEG1-CH2COOH,
Bromo-PEG1-acetic acid,
BIPG1337,
SCHEMBL2581545,
ZINC88189984,
FCH1216972,
BP-22284,
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| Complexity | 73.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.001g/mol |
| Monoisotopic Mass | 181.958g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number