1-(2-Aminophenyl)azetidine-3-carboxylic acid - CAS 887595-81-5
Catalog: |
BB074608 |
Product Name: |
1-(2-Aminophenyl)azetidine-3-carboxylic acid |
CAS: |
887595-81-5 |
Synonyms: |
1-(2-AMINOPHENYL)AZETIDINE-3-CARBOXYLIC ACID; 1-(2-AMINOPHENYL)AZETIDINE-3-CARBOXYLICACID |
IUPAC Name: | 1-(2-aminophenyl)azetidine-3-carboxylic acid |
Description: | 1-(2-Aminophenyl)azetidine-3-carboxylic acid |
Molecular Weight: | 192.21 |
Molecular Formula: | C10H12N2O2 |
Canonical SMILES: | C1C(CN1C2=CC=CC=C2N)C(=O)O |
InChI: | InChI=1S/C10H12N2O2/c11-8-3-1-2-4-9(8)12-5-7(6-12)10(13)14/h1-4,7H,5-6,11H2,(H,13,14) |
InChI Key: | QUSIGIRDLRJTSL-UHFFFAOYSA-N |
Complexity: | 226 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 192.08987763 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 192.08987763 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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