2-(4-Amino-3-methylphenyl)acetic Acid - CAS 705240-99-9
Catalog: |
BB034168 |
Product Name: |
2-(4-Amino-3-methylphenyl)acetic Acid |
CAS: |
705240-99-9 |
Synonyms: |
2-(4-amino-3-methylphenyl)acetic acid; 2-(4-amino-3-methylphenyl)acetic acid |
IUPAC Name: | 2-(4-amino-3-methylphenyl)acetic acid |
Description: | 2-(4-Amino-3-methylphenyl)acetic Acid (CAS# 705240-99-9) is a useful research chemical. |
Molecular Weight: | 165.19 |
Molecular Formula: | C9H11NO2 |
Canonical SMILES: | CC1=C(C=CC(=C1)CC(=O)O)N |
InChI: | InChI=1S/C9H11NO2/c1-6-4-7(5-9(11)12)2-3-8(6)10/h2-4H,5,10H2,1H3,(H,11,12) |
InChI Key: | LTCIAYCHYFURKB-UHFFFAOYSA-N |
LogP: | 1.78550 |
Publication Number | Title | Priority Date |
CN-111777520-A | Synthesis method of multi-substituted dimethylamino phenyl acetic acid compound | 20200722 |
CA-3050056-A1 | Rorgamma modulators and uses thereof | 20170127 |
EP-3573972-A1 | Rorgamma modulators and uses thereof | 20170127 |
US-2020000815-A1 | Rorgamma modulators and uses thereof | 20170127 |
WO-2018138359-A1 | Rorgamma modulators and uses thereof | 20170127 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.078978594 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 63.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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