3-Chloro-1-(4-pivaloyloxyphenyl)propan-1-one - CAS 1797891-14-5
Catalog: |
BB062450 |
Product Name: |
3-Chloro-1-(4-pivaloyloxyphenyl)propan-1-one |
CAS: |
1797891-14-5 |
Synonyms: |
3-Chloro-1-(4-pivaloyloxyphenyl)propan-1-one; [4-(3-Chloropropanoyl)phenyl] 2,2-dimethylpropanoate; 4-(3-Chloropropanoyl)phenyl pivalate |
IUPAC Name: | [4-(3-chloropropanoyl)phenyl] 2,2-dimethylpropanoate |
Description: | 3-Chloro-1-(4-pivaloyloxyphenyl)propan-1-one (cas# 1797891-14-5) is a compound useful in organic synthesis. |
Molecular Weight: | 268.74 |
Molecular Formula: | C14H17ClO3 |
Canonical SMILES: | CC(C)(C)C(=O)OC1=CC=C(C=C1)C(=O)CCCl |
InChI: | InChI=1S/C14H17ClO3/c1-14(2,3)13(17)18-11-6-4-10(5-7-11)12(16)8-9-15/h4-7H,8-9H2,1-3H3 |
InChI Key: | YEVIZFQTNRQMTB-UHFFFAOYSA-N |
Solubility: | Dichloromethane |
Appearance: | Pale Yellow Solid |
Complexity: | 299 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.0866221 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.0866221 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 43.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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