3-(2-Boc-hydrazino)benzoic Acid - CAS 156899-02-4
Catalog: |
BB011275 |
Product Name: |
3-(2-Boc-hydrazino)benzoic Acid |
CAS: |
156899-02-4 |
Synonyms: |
3-[[(2-methylpropan-2-yl)oxy-oxomethyl]hydrazo]benzoic acid; 3-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]benzoic acid |
IUPAC Name: | 3-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]benzoic acid |
Description: | 3-(2-Boc-hydrazino)benzoic Acid (CAS# 156899-02-4) is a useful research chemical. |
Molecular Weight: | 252.27 |
Molecular Formula: | C12H16N2O4 |
Canonical SMILES: | CC(C)(C)OC(=O)NNC1=CC=CC(=C1)C(=O)O |
InChI: | InChI=1S/C12H16N2O4/c1-12(2,3)18-11(17)14-13-9-6-4-5-8(7-9)10(15)16/h4-7,13H,1-3H3,(H,14,17)(H,15,16) |
InChI Key: | QALBKMGURMIQOA-UHFFFAOYSA-N |
LogP: | 2.70030 |
Publication Number | Title | Priority Date |
CN-105408325-B | Cyano triazole compounds | 20130717 |
EP-2677318-A1 | Labeling agent for post-translational modification analysis of serine and threonine | 20110216 |
EP-2677318-B1 | Labeling agent for post-translational modification analysis of serine and threonine | 20110216 |
US-2014024124-A1 | Labeling agent for analyzing post-translational modifications of serine and threonine | 20110216 |
AU-2010231954-A1 | Novel amide derivatives of steroidal[3,2-c]pyrazole compounds with glucocorticoid activity | 20090403 |
Complexity: | 312 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.111007 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.111007 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 87.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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