3-(N-Boc-Amino)-5-hydroxybenzoic Acid - CAS 232595-59-4
Catalog: |
BB017991 |
Product Name: |
3-(N-Boc-Amino)-5-hydroxybenzoic Acid |
CAS: |
232595-59-4 |
Synonyms: |
3-hydroxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid; 3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid |
IUPAC Name: | 3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid |
Description: | 3-(N-Boc-Amino)-5-hydroxybenzoic Acid (CAS# 232595-59-4) is used as a reactant in the preparation of thiazolecarboxamides as vitronectin receptor antagonists. |
Molecular Weight: | 253.25 |
Molecular Formula: | C12H15NO5 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=CC(=CC(=C1)C(=O)O)O |
InChI: | InChI=1S/C12H15NO5/c1-12(2,3)18-11(17)13-8-4-7(10(15)16)5-9(14)6-8/h4-6,14H,1-3H3,(H,13,17)(H,15,16) |
InChI Key: | KSTCXQVSGVVIAO-UHFFFAOYSA-N |
Boiling Point: | 395.8 °C at 760 mmHg |
Density: | 1.337 g/cm3 |
LogP: | 2.51040 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-101642097-B1 | Novel glucokinase activators and processes for the preparation thereof | 20090922 |
KR-20110033057-A | Novel glucokinase activators and preparation methods thereof | 20090922 |
US-2012178765-A1 | Novel glucokinase activators and processes for the preparation thereof | 20090922 |
WO-2011081280-A2 | Novel glucokinase activators and processes for the preparation thereof | 20090922 |
WO-2008119772-A1 | Amide derivatives as inhibitors of aspartyl proteases | 20070330 |
Complexity: | 323 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 253.09502258 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 253.09502258 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 95.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS