Methyl 1-(Hydroxymethyl)cyclobutanecarboxylate - CAS 1073-86-5
Catalog: |
BB002071 |
Product Name: |
Methyl 1-(Hydroxymethyl)cyclobutanecarboxylate |
CAS: |
1073-86-5 |
Synonyms: |
1-(hydroxymethyl)-1-cyclobutanecarboxylic acid methyl ester; methyl 1-(hydroxymethyl)cyclobutane-1-carboxylate |
IUPAC Name: | methyl 1-(hydroxymethyl)cyclobutane-1-carboxylate |
Description: | Methyl 1-(Hydroxymethyl)cyclobutanecarboxylate (CAS# 1073-86-5) is a useful research chemical. |
Molecular Weight: | 144.17 |
Molecular Formula: | C7H12O3 |
Canonical SMILES: | COC(=O)C1(CCC1)CO |
InChI: | InChI=1S/C7H12O3/c1-10-6(9)7(5-8)3-2-4-7/h8H,2-5H2,1H3 |
InChI Key: | VCGQWVIOCHFYDL-UHFFFAOYSA-N |
LogP: | 0.32200 |
Publication Number | Title | Priority Date |
CA-2956045-A1 | Carboxylic acid compound, method for preparation thereof, and use thereof | 20140813 |
CN-105439946-B | Carboxylic acid compound and its production and use | 20140813 |
CN-106573908-A | Carboxylic acid compound, method for preparation thereof, and use thereof | 20140813 |
EP-3181557-A1 | Carboxylic acid compound, method for preparation thereof, and use thereof | 20140813 |
US-2017233376-A1 | Carboxylic acid compound, method for preparation thereof, and use thereof | 20140813 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.078644241 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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