Ethyl 2-(3-piperidinyl)acetate - CAS 64995-88-6
Catalog: |
BB043104 |
Product Name: |
Ethyl 2-(3-piperidinyl)acetate |
CAS: |
64995-88-6 |
Synonyms: |
2-(Piperidin-3-yl)-acetic acid ethyl ester; Ethyl 2-(3-piperidyl)acetate; ethyl piperidin-3-ylacetate |
IUPAC Name: | ethyl 2-piperidin-3-ylacetate |
Description: | Ethyl 2-(3-piperidinyl)acetate (CAS# 64995-88-6 ) is a useful research chemical. |
Molecular Weight: | 171.24 |
Molecular Formula: | C9H17NO2 |
Canonical SMILES: | CCOC(=O)CC1CCCNC1 |
InChI: | InChI=1S/C9H17NO2/c1-2-12-9(11)6-8-4-3-5-10-7-8/h8,10H,2-7H2,1H3 |
InChI Key: | RJFIWCWTENIBKC-UHFFFAOYSA-N |
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: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.125928785 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.125928785 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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