Ethyl 1-methylpyrrolidine-3-carboxylate - CAS 14398-95-9
Catalog: |
BB042579 |
Product Name: |
Ethyl 1-methylpyrrolidine-3-carboxylate |
CAS: |
14398-95-9 |
Synonyms: |
3-Pyrrolidinecarboxylic acid, 1-methyl-, ethyl ester |
IUPAC Name: | ethyl 1-methylpyrrolidine-3-carboxylate |
Description: | Ethyl 1-methylpyrrolidine-3-carboxylate (CAS# 14398-95-9 ) is a useful research chemical. |
Molecular Weight: | 157.21 |
Molecular Formula: | C8H15NO2 |
Canonical SMILES: | CCOC(=O)C1CCN(C1)C |
InChI: | InChI=1S/C8H15NO2/c1-3-11-8(10)7-4-5-9(2)6-7/h7H,3-6H2,1-2H3 |
InChI Key: | DHWKOWPDAGMVOD-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: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.110278721 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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Related Functional Groups
Pyrrolidines
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