tert- Butyl 3- Cyclopropyl- 3- oxopropanoate - CAS 134302-07-1
Catalog: |
BB055131 |
Product Name: |
tert- Butyl 3- Cyclopropyl- 3- oxopropanoate |
CAS: |
134302-07-1 |
Synonyms: |
tert-butyl 3-cyclopropyl-3-oxopropanoate; tert-Butyl b-oxo-cyclopropanepropanoate; BETA-OXO-CYCLOPROPANEPROPANOIC ACID 1,1-DIMETHYLETHYL ESTER; tert-Butylb-oxo-cyclopropanepropanoate |
IUPAC Name: | tert-butyl 3-cyclopropyl-3-oxopropanoate |
Molecular Weight: | 184.23 |
Molecular Formula: | C10H16O3 |
Canonical SMILES: | CC(C)(C)OC(=O)CC(=O)C1CC1 |
InChI: | InChI=1S/C10H16O3/c1-10(2,3)13-9(12)6-8(11)7-4-5-7/h7H,4-6H2,1-3H3 |
InChI Key: | CXPRGLWJJQBWRS-UHFFFAOYSA-N |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.109944368 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.109944368 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 43.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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