Methyl 2-azaspiro[3.3]heptane-6-carboxylate hydrochloride - CAS 2361634-43-5
Catalog: |
BB054222 |
Product Name: |
Methyl 2-azaspiro[3.3]heptane-6-carboxylate hydrochloride |
CAS: |
2361634-43-5 |
Synonyms: |
2-Azaspiro[3.3]heptane-6-carboxylic acid, methyl ester, hydrochloride (1:1) |
Related CAS: | 1607014-48-1 (free base) |
IUPAC Name: | methyl 2-azaspiro[3.3]heptane-6-carboxylate;hydrochloride |
Molecular Weight: | 191.66 |
Molecular Formula: | C8H14ClNO2 |
Canonical SMILES: | COC(=O)C1CC2(C1)CNC2.Cl |
InChI: | InChI=1S/C8H13NO2.ClH/c1-11-7(10)6-2-8(3-6)4-9-5-8;/h6,9H,2-5H2,1H3;1H |
InChI Key: | BRRUQJDMHNXPHP-UHFFFAOYSA-N |
Purity: | ≥95% |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | 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 |
Signal Word: | Warning |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.0713064 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.0713064 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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