Ethyl p-tolylacetate - CAS 14062-19-2
Catalog: |
BB009085 |
Product Name: |
Ethyl p-tolylacetate |
CAS: |
14062-19-2 |
Synonyms: |
ethyl 2-(4-methylphenyl)acetate |
IUPAC Name: | ethyl 2-(4-methylphenyl)acetate |
Description: | Ethyl p-tolylacetate (CAS# 14062-19-2) is a useful research chemical. |
Molecular Weight: | 178.23 |
Molecular Formula: | C11H14O2 |
Canonical SMILES: | CCOC(=O)CC1=CC=C(C=C1)C |
InChI: | InChI=1S/C11H14O2/c1-3-13-11(12)8-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3 |
InChI Key: | BTRGZBIXPLFVNK-UHFFFAOYSA-N |
Boiling Point: | 116-118 °C / 13 mmHg (lit.) |
Density: | 1.008 g/mL at 25°C(lit.) |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD00009181 |
LogP: | 2.10060 |
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: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.099379685 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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