Indan-2,2-dicarboxylic acid - CAS 2437-08-3
Catalog: |
BB018443 |
Product Name: |
Indan-2,2-dicarboxylic acid |
CAS: |
2437-08-3 |
Synonyms: |
2H-Indene-2,2-dicarboxylic acid, 1,3-dihydro-; 1,3-Dihydro-2H-indene-2,2-dicarboxylic acid; 2,2-Indandicarboxylic acid; 2,2-Indanedicarboxylic acid; 2,3-Dihydro-1H-indene-2,2-dicarboxylic acid; NSC 73040 |
IUPAC Name: | 1,3-dihydroindene-2,2-dicarboxylic acid |
Molecular Weight: | 206.19 |
Molecular Formula: | C11H10O4 |
Canonical SMILES: | C1C2=CC=CC=C2CC1(C(=O)O)C(=O)O |
InChI: | InChI=1S/C11H10O4/c12-9(13)11(10(14)15)5-7-3-1-2-4-8(7)6-11/h1-4H,5-6H2,(H,12,13)(H,14,15) |
InChI Key: | RYGAENQWIQPFAI-UHFFFAOYSA-N |
Boiling Point: | 456.8±45.0°C at 760 mmHg |
Melting Point: | 193°C |
Purity: | ≥95% |
Density: | 1.457±0.06 g/cm3 |
Appearance: | White to beige powder or crystals |
MDL: | MFCD00085096 |
LogP: | 0.94080 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020064175-A1 | Indane derivatives for use in the treatment of bacterial infection | 20180925 |
US-2020216501-A1 | Cyclic peptides multimers targeting alpha-4-beta-7 integrin | 20161111 |
EP-3492537-A1 | Resin for active energy ray-curable inks, composition for active energy ray-curable inks, active energy ray-curable ink and cured film | 20160726 |
JP-2018016688-A | Active energy ray curable ink resin, active energy ray curable ink composition, active energy ray curable ink and cured film | 20160726 |
JP-6378720-B2 | Active energy ray curable ink resin, active energy ray curable ink composition, active energy ray curable ink and cured film | 20160726 |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.05790880 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.05790880 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 74.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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