170848-34-7
Product Name:
BOC-3-IODO-D-ALANINE METHYL ESTER
Formula:
C9H16INO4
Synonyms:
N-(tert-Butoxycarbonyl)-3-iodo-D -alanine methyl ester;Boc-β-iodo-D -Ala-OMe;Boc-3-iodo-D -alanine methyl ester
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SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 329.13 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 329.01241 g/mol |
| Monoisotopic Mass | 329.01241 g/mol |
| Topological Polar Surface Area | 64.6 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 237 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |