1-(4-Methoxyphenyl)-2-methylpropan-2-amine - CAS 56490-94-9
Catalog: |
BB044597 |
Product Name: |
1-(4-Methoxyphenyl)-2-methylpropan-2-amine |
CAS: |
56490-94-9 |
Synonyms: |
1,1-dimethyl-2-(4-methoxyphenyl)ethylamine; 2-(4-Methoxy-phenyl)-1,1-dimethyl-ethylamine; 2-methyl-1-(4-methoxyphenyl)-2-propanamine; 1-(4-Methoxyphenyl)-2-methyl-2-propanamine |
IUPAC Name: | 1-(4-methoxyphenyl)-2-methylpropan-2-amine |
Description: | 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (CAS# 56490-94-9 ) is a useful research chemical. |
Molecular Weight: | 179.26 |
Molecular Formula: | C11H17NO |
Canonical SMILES: | CC(C)(CC1=CC=C(C=C1)OC)N |
InChI: | InChI=1S/C11H17NO/c1-11(2,12)8-9-4-6-10(13-3)7-5-9/h4-7H,8,12H2,1-3H3 |
InChI Key: | DUMKDWRRTLFHTA-UHFFFAOYSA-N |
Boiling Point: | 269.4±15.0 °C (Predicted) |
Purity: | ≥ 97 % |
Density: | 0.979±0.06 g/cm3 (Predicted) |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.131014166 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.131014166 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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Amines and Anilines
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