4-(2-Methyl-1H-imidazol-1-yl)aniline - CAS 74852-81-6
Catalog: |
BB050162 |
Product Name: |
4-(2-Methyl-1H-imidazol-1-yl)aniline |
CAS: |
74852-81-6 |
Synonyms: |
4-(2-Methylimidazol-1-yl)phenylamine; 4-(2-methyl-1H-imidazol-1-yl)benzenamine; Benzenamine, 4-(2-methyl-1H-imidazol-1-yl)-; 4-(2-methylimidazolyl)phenylamine; 4-(2-Methyl-1H-imidazol-1-yl)phenylamine |
IUPAC Name: | 4-(2-methylimidazol-1-yl)aniline |
Description: | 4-(2-Methyl-1H-imidazol-1-yl)aniline (CAS# 74852-81-6 ) is a useful research chemical. |
Molecular Weight: | 173.21 |
Molecular Formula: | C10H11N3 |
Canonical SMILES: | CC1=NC=CN1C2=CC=C(C=C2)N |
InChI: | InChI=1S/C10H11N3/c1-8-12-6-7-13(8)10-4-2-9(11)3-5-10/h2-7H,11H2,1H3 |
InChI Key: | IEZCMVRWKNEHJB-UHFFFAOYSA-N |
Boiling Point: | 378.5±44.0 °C (Predicted) |
Melting Point: | 111.5 °C |
Purity: | 95 % |
Density: | 1.17±0.1 g/cm3 (Predicted) |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 164 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 173.095297364 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 173.095297364 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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Related Functional Groups
Amines and Anilines
Imidazoles
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