Cyclohexanebutyric acid - CAS 4441-63-8
Catalog: |
BB025606 |
Product Name: |
Cyclohexanebutyric acid |
CAS: |
4441-63-8 |
Synonyms: |
4-cyclohexylbutanoic acid |
IUPAC Name: | 4-cyclohexylbutanoic acid |
Description: | Cyclohexanebutyric acid (CAS# 4441-63-8) is a useful research chemical. |
Molecular Weight: | 170.25 |
Molecular Formula: | C10H18O2 |
Canonical SMILES: | C1CCC(CC1)CCCC(=O)O |
InChI: | InChI=1S/C10H18O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h9H,1-8H2,(H,11,12) |
InChI Key: | UVZMNGNFERVGRC-UHFFFAOYSA-N |
Boiling Point: | 283.3 ℃ at 760 mmHg |
Density: | 0.991 g/cm3 |
Appearance: | White solid |
MDL: | MFCD00001529 |
LogP: | 2.82160 |
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 |
Publication Number | Title | Priority Date |
EP-3834805-A1 | Dental resin modified glass-ionomer composition and kit comprising said composition | 20191212 |
WO-2021116275-A1 | Dental resin modified glass-ionomer composition and kit comprising said composition | 20191212 |
WO-2021119554-A1 | Compositions and methods for potentiating immune activity | 20191212 |
WO-2020229096-A1 | Method for bonding three-dimensional articles made by additive manufacturing | 20190510 |
WO-2020152004-A1 | Multi-component cleaning system | 20190121 |
PMID | Publication Date | Title | Journal |
21459409 | 20110701 | Naphthenic acid biodegradation by the unicellular alga Dunaliella tertiolecta | Chemosphere |
20676204 | 20100601 | Formation of PbSe/CdSe Core/Shell Nanocrystals for Stable Near-Infrared High Photoluminescence Emission | Nanoscale research letters |
15835163 | 20040330 | Synthesis of ZnO nanoparticles on a clay mineral surface in dimethyl sulfoxide medium | Langmuir : the ACS journal of surfaces and colloids |
11589966 | 20011022 | Biosynthesis of polyhydroxyalkanoate copolyester containing cyclohexyl groups by Pseudomonas oleovorans | International journal of biological macromolecules |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.130679813 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.130679813 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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