| CAS Number | 686267-65-2 |
| Catalog Number | AG00IBUX(AGN-PC-0OGLN3) |
| Chemical Name | (E)-2-(2-Benzylidenehydrazinyl)benzoic acid |
| IUPAC Name | 2-[(2E)-2-benzylidenehydrazinyl]benzoic acid |
| InChI | InChI=1S/C14H12N2O2/c17-14(18)12-8-4-5-9-13(12)16-15-10-11-6-2-1-3-7-11/h1-10,16H,(H,17,18)/b15-10+ |
| InChI Key | JWHPRNIQGLRBPH-XNTDXEJSSA-N |
| MDL Number | MFCD02246103 |
| Molecular Formula | C14H12N2O2 |
| Molecular Weight | 240.2573 |
| NSC Number | 9359 |
| SMILES | OC(=O)C1=C(NN=CC2=CC=CC=C2)C=CC=C1 |
| Synonyms | (E)-2-(2-BENZYLIDENEHYDRAZINYL)BENZOIC ACID,
2-[(2E)-2-benzylidenehydrazinyl]benzoic acid,
686267-65-2,
4036-59-3,
MLS002638085,
JWHPRNIQGLRBPH-XNTDXEJSSA-N,
NSC9359,
2-[(2E)-2-Benzylidenehydrazino]benzoic acid,
SCHEMBL1522386,
NSC-9359,
AR3035,
BBL018268,
MFCD02246103,
STL134671,
ZINC31613704,
AKOS005744939,
o-(2-Benzylidenehydrazino)benzoic acid,
AS-45510,
T9336,
2-[(2E)-2-Benzylidenehydrazino]benzoic acid #,
CID9561044,
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| Complexity | 298 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 240.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.262g/mol |
| Monoisotopic Mass | 240.09g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 61.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number