| CAS Number | 23761-26-4 |
| Catalog Number | AG00BJ67(AGN-PC-0WD19X) |
| Chemical Name | 3-hydroxy-3-phenyl-cyclobutanecarboxylic acid |
| IUPAC Name | 3-hydroxy-3-phenylcyclobutane-1-carboxylic acid |
| InChI | InChI=1S/C11H12O3/c12-10(13)8-6-11(14,7-8)9-4-2-1-3-5-9/h1-5,8,14H,6-7H2,(H,12,13) |
| InChI Key | PAVXBGIOIYHQMN-UHFFFAOYSA-N |
| MDL Number | MFCD20643621 |
| Molecular Formula | C11H12O3 |
| Molecular Weight | 192.2112 |
| SMILES | c1cccc(c1)C1(CC(C1)C(=O)O)O |
| Synonyms | 23761-26-4,
3-Hydroxy-3-phenylcyclobutanecarboxylic acid,
3-hydroxy-3-phenylcyclobutane-1-carboxylic acid,
3-Hydroxy-3-phenyl-cyclobutanecarboxylic acid,
3-Hydroxy-3-phenyl-cyclobutanecarboxylicacid,
SCHEMBL16993536,
DTXSID50856099,
MFCD20643621,
ZINC88077391,
AKOS016013387,
AKOS030628597,
KS-000008N5,
AM807354,
AS-51502,
SC-20111,
AB0048249,
AJ-128100,
CS-0051340,
W-4940,
F2147-5132,
3-Hydroxy-3-phenylcyclobutanecarboxylicacid,
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| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.214g/mol |
| Monoisotopic Mass | 192.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number