HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 11368145Generated: October 30, 2026
(S)-N-Boc-1,2,3,6-tetrahydro-2-pyridinecarboxylic acid
TB-1764 · (S)-N-Boc-1,2,3,6-Tetrahydro-2-picolinic acid · (S)-1-Boc-3,6-dihydro-2H-pyridine-2-carboxylic acid · (S)-N-Boc-1,2,3,6-tetrahydro-2-pyridinecarboxylic acid · (S)-1-(tert-butoxycarbonyl)-1,2,3,6-tetrahydropyridine-2-carboxylic acid · 1,2(2H)-Pyridinedicarboxylic acid, 3,6-dihydro-, 1-(1,1-dimethylethyl) ester, (2S)-
https://huagongshe.com/en/chemical/11368145
Identifiers & Physical Properties
| CAS No. | 417726-36-4 |
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| Molecular formula | C11H17NO4 |
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| Average molar mass | 227.26 g/mol |
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| Monoisotopic mass | 227.11575802 g/mol |
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| SMILES | CC(C)(C)OC(=O)N1CC=CC[C@H]1C(=O)O |
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| InChIKey | SSYLTDCVONDKNS-QMMMGPOBSA-N |
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| PubChem CID | 11368145 |
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| EC No. | 625-858-9 |
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| DTXSID | DTXSID00463752 |
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Chemical & Physical Properties
| XLogP | 1.4 |
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| Topological polar surface area | 66.8 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 16 |
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| Formal charge | 0 |
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| Complexity | 316 |
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| Physical state | solid |
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| optical activity | [α]/D -4.0±2.0°, c = 1 in methylene chloride |
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| BRN | 9049382 |
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| InChI | 1S/C11H17NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h4-5,8H,6-7H2,1-3H3,(H,13,14)/t8-/m0/s1 |
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| InChIKey | SSYLTDCVONDKNS-QMMMGPOBSA-N |
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| SMILES | CC(C)(C)OC(=O)N1CC=CC[C@H]1C(O)=O |
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| UNSPSC Code | 12352005 |
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| NACRES | NA.22 |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H315-H319-H335 |
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| GHS precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
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| Target organs | Respiratory system |
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| Personal protective equipment (PPE) | dust mask type N95 (US), Eyeshields, Gloves |
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| Hazard symbols | Xi |
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| Risk statements (R) | 36/37/38 |
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| Safety statements (S) | 26 |
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| Water hazard class (WGK) | 3 |
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| Storage class | 11 - Combustible Solids |
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| Hazard class | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
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Safety & Regulations
| GHS classification | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Personal protective equipment (PPE) | dust mask type N95 (US), Eyeshields, Gloves |
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| Water hazard class (WGK) | 3 |
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| Risk statements (R) | 36/37/38 |
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| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| Hazard symbols | Xi |
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| Safety statements (S) | 26 |
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| Storage class | 11 - Combustible Solids |
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| Target organs | Respiratory system |
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| GHS hazard statements | H315-H319-H335 |
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| Hazard class | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
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| GHS precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
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