| CAS Number | 25393-20-8 |
| Catalog Number | AG003DWC(AGN-PC-00089G) |
| Chemical Name | 2-(1-acetylpiperidin-2-yl)acetic acid |
| IUPAC Name | 2-(1-acetylpiperidin-2-yl)acetic acid |
| InChI | InChI=1S/C9H15NO3/c1-7(11)10-5-3-2-4-8(10)6-9(12)13/h8H,2-6H2,1H3,(H,12,13) |
| InChI Key | FMJUSBGJDLWLGD-UHFFFAOYSA-N |
| MDL Number | MFCD12784528 |
| Molecular Formula | C9H15NO3 |
| Molecular Weight | 185.2203 |
| SMILES | CC(N1C(CC(O)=O)CCCC1)=O |
| Synonyms | 1-Acetyl-2-piperidineacetic Acid,
25393-20-8,
2-(1-acetylpiperidin-2-yl)acetic acid,
AC1Q1KDS,
1-Acetyl-2-piperidineaceticAcid,
SCHEMBL12606503,
KS-00000CVD,
5037AJ,
MFCD12784528,
2-(1-acetyl-2-piperidyl)acetic acid,
AKOS010237867,
TRA0014722,
AS-32126,
SY023396,
FT-0708312,
EN300-61907,
Z-3395,
MFCD12784528 (95+%),
C9H15NO3,
109-85-3,
|
| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.223g/mol |
| Monoisotopic Mass | 185.105g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number