2-[4-(methoxy)phenyl]pyrrolidine - CAS 74190-66-2
Catalog: |
BB053497 |
Product Name: |
2-[4-(methoxy)phenyl]pyrrolidine |
CAS: |
74190-66-2 |
Synonyms: |
2-(4-Methoxy-phenyl)-pyrrolidine; 2-[4-(methoxy)phenyl]pyrrolidine; 4-Methoxy-1-pyrrolidin-2-ylbenzene |
IUPAC Name: | 2-(4-methoxyphenyl)pyrrolidine |
Molecular Weight: | 177.24 |
Molecular Formula: | C11H15NO |
Canonical SMILES: | COC1=CC=C(C=C1)C2CCCN2 |
InChI: | InChI=1S/C11H15NO/c1-13-10-6-4-9(5-7-10)11-3-2-8-12-11/h4-7,11-12H,2-3,8H2,1H3 |
InChI Key: | HCBLZPKEGFYHDN-UHFFFAOYSA-N |
Purity: | 95% |
Appearance: | Colorless to Light Yellow to Light Orange Clear Liquid |
GHS Hazard Statement: | H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral]; 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.115364102 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 21.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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