4-Bromo-3,5-dimethylaniline - CAS 59557-90-3
Catalog: |
BB030421 |
Product Name: |
4-Bromo-3,5-dimethylaniline |
CAS: |
59557-90-3 |
Synonyms: |
4-bromo-3,5-dimethylaniline; 4-bromo-3,5-dimethylaniline |
IUPAC Name: | 4-bromo-3,5-dimethylaniline |
Description: | 4-Bromo-3,5-dimethylaniline (CAS# 59557-90-3) is a useful research chemical. |
Molecular Weight: | 200.08 |
Molecular Formula: | C8H10BrN |
Canonical SMILES: | CC1=CC(=CC(=C1Br)C)N |
InChI: | InChI=1S/C8H10BrN/c1-5-3-7(10)4-6(2)8(5)9/h3-4H,10H2,1-2H3 |
InChI Key: | OGBPXDJLNYCSJH-UHFFFAOYSA-N |
Boiling Point: | 260.992 ℃ at 760 mmHg |
Density: | 1.425 g/cm3 |
MDL: | MFCD07780648 |
LogP: | 3.22930 |
Publication Number | Title | Priority Date |
CN-110183475-B | Biboroxapyrene compound based on donor-acceptor and application thereof | 20190603 |
WO-2020191261-A1 | Indazoles as lrrk2 inhibitors | 20190321 |
CN-109575058-A | Two boron pyrene derivatives of 4,10- dioxy -5,9-, preparation method and application | 20181219 |
CN-109575058-B | 4, 10-dioxo-5, 9-diboropyrene derivative, preparation method and application | 20181219 |
CN-109970763-B | Preparation method of DGAT1 inhibitor | 20171227 |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.99966 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.99966 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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