1-(4-Aminophenyl)-2-pyrrolidinone - CAS 13691-22-0
Catalog: |
BB008477 |
Product Name: |
1-(4-Aminophenyl)-2-pyrrolidinone |
CAS: |
13691-22-0 |
Synonyms: |
1-(4-aminophenyl)pyrrolidin-2-one |
IUPAC Name: | 1-(4-aminophenyl)pyrrolidin-2-one |
Description: | 1-(4-Aminophenyl)-2-pyrrolidinone (CAS# 13691-22-0) is a useful research chemical. |
Molecular Weight: | 176.22 |
Molecular Formula: | C10H12N2O |
Canonical SMILES: | C1CC(=O)N(C1)C2=CC=C(C=C2)N |
InChI: | InChI=1S/C10H12N2O/c11-8-3-5-9(6-4-8)12-7-1-2-10(12)13/h3-6H,1-2,7,11H2 |
InChI Key: | IOMOVAPYJQVJDK-UHFFFAOYSA-N |
Boiling Point: | 462.2 °C at 760 mmHg |
Density: | 1.234 g/cm3 |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
MDL: | MFCD00100993 |
LogP: | 2.04180 |
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 |
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Complexity: | 197 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.094963011 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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Related Functional Groups
Carbonyl Compounds
Pyrrolidines
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