2-Amino-5-bromo-4-methyl-3-nitropyridine - CAS 100367-40-6
Catalog: |
BB000197 |
Product Name: |
2-Amino-5-bromo-4-methyl-3-nitropyridine |
CAS: |
100367-40-6 |
Synonyms: |
5-bromo-4-methyl-3-nitro-2-pyridinamine; 5-bromo-4-methyl-3-nitropyridin-2-amine |
IUPAC Name: | 5-bromo-4-methyl-3-nitropyridin-2-amine |
Description: | 2-Amino-5-bromo-4-methyl-3-nitropyridine (CAS# 100367-40-6) is a compound useful in organic synthesis. |
Molecular Weight: | 232.03 |
Molecular Formula: | C6H6BrN3O2 |
Canonical SMILES: | CC1=C(C(=NC=C1Br)N)[N+](=O)[O-] |
InChI: | InChI=1S/C6H6BrN3O2/c1-3-4(7)2-9-6(8)5(3)10(11)12/h2H,1H3,(H2,8,9) |
InChI Key: | KFVGEPWMVKZPND-UHFFFAOYSA-N |
Boiling Point: | 314.1 °C at 760 mmHg |
Density: | 1.795 g/cm3 |
Appearance: | Solid |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD00092197 |
LogP: | 2.74730 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.96434 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.96434 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 84.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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Amines and Anilines
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