4-Methoxy-1H-pyrrole-2-carboxylic Acid - CAS 90724-66-6
Catalog: |
BB039937 |
Product Name: |
4-Methoxy-1H-pyrrole-2-carboxylic Acid |
CAS: |
90724-66-6 |
Synonyms: |
4-methoxy-1H-pyrrole-2-carboxylic acid; 4-methoxy-1H-pyrrole-2-carboxylic acid |
IUPAC Name: | 4-methoxy-1H-pyrrole-2-carboxylic acid |
Description: | 4-Methoxy-1H-pyrrole-2-carboxylic Acid (CAS# 90724-66-6 ) is a useful research chemical. |
Molecular Weight: | 141.12 |
Molecular Formula: | C6H7NO3 |
Canonical SMILES: | COC1=CNC(=C1)C(=O)O |
InChI: | InChI=1S/C6H7NO3/c1-10-4-2-5(6(8)9)7-3-4/h2-3,7H,1H3,(H,8,9) |
InChI Key: | JMDVLCHZHALXPK-UHFFFAOYSA-N |
Boiling Point: | 368.3 °C at 760 mmHg |
Density: | 1.353 g/cm3 |
LogP: | 0.72150 |
Publication Number | Title | Priority Date |
AU-2005210652-A1 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | 20040202 |
CA-2554155-A1 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | 20040202 |
EP-1737417-A2 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | 20040202 |
JP-2007522134-A | Keratin staining compounds, keratin staining compositions containing them, and uses thereof | 20040202 |
KR-20060127951-A | Keratin dyeing compounds, keratin dyeing compositions containing the same and uses thereof | 20040202 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.042593085 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.042593085 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 62.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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