2'-(Methylamino)biphenyl-3-carboxylic acid - CAS 1215206-12-4
Catalog: |
BB059424 |
Product Name: |
2'-(Methylamino)biphenyl-3-carboxylic acid |
CAS: |
1215206-12-4 |
Synonyms: |
2'-(METHYLAMINO)BIPHENYL-3-CARBOXYLIC ACID; 3-[2-(methylamino)phenyl]benzoic acid; 2-(Methylamino)biphenyl-3-carboxylic acid |
IUPAC Name: | 3-[2-(methylamino)phenyl]benzoic acid |
Description: | 2'-(Methylamino)biphenyl-3-carboxylic acid |
Molecular Weight: | 227.26 |
Molecular Formula: | C14H13NO2 |
Canonical SMILES: | CNC1=CC=CC=C1C2=CC(=CC=C2)C(=O)O |
InChI: | InChI=1S/C14H13NO2/c1-15-13-8-3-2-7-12(13)10-5-4-6-11(9-10)14(16)17/h2-9,15H,1H3,(H,16,17) |
InChI Key: | OUXPNNDERWQIOZ-UHFFFAOYSA-N |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.094628657 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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