Methyl 2-[1-(Mercaptomethyl)cyclopropyl]acetate - CAS 152922-73-1
Catalog: |
BB010827 |
Product Name: |
Methyl 2-[1-(Mercaptomethyl)cyclopropyl]acetate |
CAS: |
152922-73-1 |
Synonyms: |
2-[1-(mercaptomethyl)cyclopropyl]acetic acid methyl ester; methyl 2-[1-(sulfanylmethyl)cyclopropyl]acetate |
IUPAC Name: | methyl 2-[1-(sulfanylmethyl)cyclopropyl]acetate |
Description: | Methyl 2-[1-(Mercaptomethyl)cyclopropyl]acetate (CAS# 152922-73-1) is a useful research chemical. |
Molecular Weight: | 160.23 |
Molecular Formula: | C7H12O2S |
Canonical SMILES: | COC(=O)CC1(CC1)CS |
InChI: | InChI=1S/C7H12O2S/c1-9-6(8)4-7(5-10)2-3-7/h10H,2-5H2,1H3 |
InChI Key: | JRHLVNAWLWIHDN-UHFFFAOYSA-N |
Boiling Point: | 208.899 °C at 760 mmHg |
Density: | 1.11 g/cm3 |
LogP: | 1.25950 |
Publication Number | Title | Priority Date |
KR-102130043-B1 | Uracil-based compound and herbicidal composition comprising same | 20180710 |
TW-202003467-A | Novel salt forms of URAT-1 inhibitors | 20180328 |
US-2021032204-A1 | Novel salt forms of urat-1 inhibitors | 20180328 |
AU-2015303597-A1 | Carboxylic acid compound, method for preparation thereof, and use thereof | 20140813 |
AU-2015303597-B2 | Carboxylic acid compound, method for preparation thereof, and use thereof | 20140813 |
Complexity: | 141 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.05580079 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.05580079 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 27.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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