| CAS Number | 1347750-75-7 |
| Catalog Number | AG009VU1(AGN-PC-0WR0QY) |
| Chemical Name | Boc-9-AMino-4,7-Dioxanonanoic acid |
| IUPAC Name | 3-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]ethoxy]propanoic acid |
| InChI | InChI=1S/C14H27NO7/c1-14(2,3)22-13(18)15-5-7-20-9-11-21-10-8-19-6-4-12(16)17/h4-11H2,1-3H3,(H,15,18)(H,16,17) |
| InChI Key | PFAQEUVPPBOTTA-UHFFFAOYSA-N |
| MDL Number | MFCD24539476 |
| Molecular Formula | C14H27NO7 |
| Molecular Weight | 321.3667 |
| SMILES | CC(C)(OC(NCCOCCOCCOCCC(=O)O)=O)C |
| Synonyms | 1347750-75-7,
t-Boc-N-amido-PEG3-acid,
Boc-NH-PEG3-CH2CH2COOH,
2,2-Dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azaheptadecan-17-oic acid,
Boc-9-Amino-4,7-Dioxanonanoic acid,
Boc-NH-PEG3-propionic acid,
BIPG1801,
SCHEMBL7263734,
t-boc-N-amido-PEG3-propionic acid,
MFCD24539476,
ZINC96307093,
AKOS030213692,
AK680582,
BP-21656,
3-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]ethoxy]propanoic acid,
|
| Complexity | 315 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 321.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 321.37g/mol |
| Monoisotopic Mass | 321.179g/mol |
| Rotatable Bond Count | 14 |
| Topological Polar Surface Area | 103A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H315-H319-H335
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Packing Group
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\N
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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\N
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Certificate of Analysis
Lot Number