2-Amino-4-(4-nitrophenyl)thiazole - CAS 2104-09-8
Catalog: |
BB016561 |
Product Name: |
2-Amino-4-(4-nitrophenyl)thiazole |
CAS: |
2104-09-8 |
Synonyms: |
4-(4-nitrophenyl)-1,3-thiazol-2-amine |
IUPAC Name: | 4-(4-nitrophenyl)-1,3-thiazol-2-amine |
Description: | 2-Amino-4-(4-nitrophenyl)thiazole (CAS# 2104-09-8) is a useful reagent in the preparation of 2-aminothiazole derivatives with biological properties. |
Molecular Weight: | 221.24 |
Molecular Formula: | C9H7N3O2S |
Canonical SMILES: | C1=CC(=CC=C1C2=CSC(=N2)N)[N+](=O)[O-] |
InChI: | InChI=1S/C9H7N3O2S/c10-9-11-8(5-15-9)6-1-3-7(4-2-6)12(13)14/h1-5H,(H2,10,11) |
InChI Key: | RIKJWJIWXCUKQV-UHFFFAOYSA-N |
Boiling Point: | 448.4 °C at 760 mmHg |
Melting Point: | 283-287 °C |
Purity: | 95 % |
Density: | 1.459 g/cm3 |
Appearance: | White to tan to orange powder, crystals, or crystalline powder and/or chunks |
MDL: | MFCD00170222 |
LogP: | 3.40490 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-108822056-A | A kind of synthetic method of Novel 2 Amino thiazole ring analog derivative | 20180814 |
CN-108863978-A | A method of by ethylbenzene class compound synthesis thiazolamine cyclics | 20180814 |
CN-107501204-A | A kind of method that 1,3 substituted thiazole cyclics are synthesized by styrene compound | 20170901 |
CN-107501204-B | Method for synthesizing 1, 3-substituted thiazole ring compound from styrene compound | 20170901 |
CN-107556264-A | A kind of synthetic method of novel thiazole ring analog derivative | 20170901 |
PMID | Publication Date | Title | Journal |
20177467 | 20090101 | Synthesis and Antibacterial Assessment of N-[4-(4-substituted phenyl)-1,3-thiazol-2-yl]-1,3,5-triazin-2-amine | Indian journal of pharmaceutical sciences |
Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.02589765 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.02589765 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 113 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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