1-Cyclopentene-1,2-dicarboxylic anhydride - CAS 3205-94-5
Catalog: |
BB021150 |
Product Name: |
1-Cyclopentene-1,2-dicarboxylic anhydride |
CAS: |
3205-94-5 |
Synonyms: |
5,6-dihydro-4H-cyclopenta[c]furan-1,3-dione |
IUPAC Name: | 5,6-dihydro-4H-cyclopenta[c]furan-1,3-dione |
Description: | 1-Cyclopentene-1,2-dicarboxylic anhydride (CAS# 3205-94-5) is a useful research chemical compound. |
Molecular Weight: | 138.12 |
Molecular Formula: | C7H6O3 |
Canonical SMILES: | C1CC2=C(C1)C(=O)OC2=O |
InChI: | InChI=1S/C7H6O3/c8-6-4-2-1-3-5(4)7(9)10-6/h1-3H2 |
InChI Key: | GBBPFLCLIBNHQO-UHFFFAOYSA-N |
Boiling Point: | 133-135 °C / 10 mmHg (lit.) |
Melting Point: | 42-45 °C (lit.) |
Flash Point: | 235.4 °CF - closed cup |
Purity: | 96 % |
Density: | 1.37 g/cm3 |
Appearance: | White to tan powder, crystals or flakes |
MDL: | MFCD00013330 |
LogP: | 0.55030 |
Refractive Index: | n20/D 1.4978 (lit.) |
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 |
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Complexity: | 226 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 138.031694049 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 138.031694049 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 43.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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