1-Chloroethyl ethyl carbonate - CAS 50893-36-2
Catalog: |
BB027249 |
Product Name: |
1-Chloroethyl ethyl carbonate |
CAS: |
50893-36-2 |
Synonyms: |
1-chloroethyl ethyl carbonate |
IUPAC Name: | 1-chloroethyl ethyl carbonate |
Description: | 1-Chloroethyl ethyl carbonate (CAS# 50893-36-2) is a useful research chemical. |
Molecular Weight: | 152.58 |
Molecular Formula: | C5H9ClO3 |
Canonical SMILES: | CCOC(=O)OC(C)Cl |
InChI: | InChI=1S/C5H9ClO3/c1-3-8-5(7)9-4(2)6/h4H,3H2,1-2H3 |
InChI Key: | YVRGKFXJZCTTRB-UHFFFAOYSA-N |
Boiling Point: | 159-161 °C (lit.) |
Melting Point: | 159-161 °C |
Purity: | 95 % |
Density: | 1.136 g/cm3 |
Appearance: | Clear pale yellowish liquid |
Storage: | 2-8 °C |
MDL: | MFCD00040523 |
LogP: | 1.74430 |
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 |
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Complexity: | 94.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0240218 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0240218 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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