1-Isopropylpiperidine-4-carboxylic Acid Hydrochloride - CAS 117704-80-0
Catalog: |
BB003988 |
Product Name: |
1-Isopropylpiperidine-4-carboxylic Acid Hydrochloride |
CAS: |
117704-80-0 |
Synonyms: |
1-propan-2-yl-4-piperidinecarboxylic acid;hydrochloride; 1-propan-2-ylpiperidine-4-carboxylic acid;hydrochloride |
IUPAC Name: | 1-propan-2-ylpiperidine-4-carboxylic acid;hydrochloride |
Description: | 1-Isopropylpiperidine-4-carboxylic Acid Hydrochloride (CAS# 117704-80-0) is a useful research chemical. |
Molecular Weight: | 207.70 |
Molecular Formula: | C9H18ClNO2 |
Canonical SMILES: | CC(C)N1CCC(CC1)C(=O)O.Cl |
InChI: | InChI=1S/C9H17NO2.ClH/c1-7(2)10-5-3-8(4-6-10)9(11)12;/h7-8H,3-6H2,1-2H3,(H,11,12);1H |
InChI Key: | CEPJGCZBWYSENC-UHFFFAOYSA-N |
MDL: | MFCD06800893 |
LogP: | 1.93130 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021175200-A1 | Ferroptosis inhibitorsâ€"diarylamine para-acetamides | 20200302 |
US-2021169804-A1 | Nanomaterials | 20191206 |
WO-2021113365-A1 | Nanomaterials | 20191206 |
JP-2005179272-A | Malonate crystals of carboxamide derivatives | 20031219 |
AU-2004204003-A1 | Condensed furan compounds | 20030109 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.1026065 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.1026065 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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