4-Trans-butyl cyclohexane carboxylic acid - CAS 38289-28-0
Catalog: |
BB053713 |
Product Name: |
4-Trans-butyl cyclohexane carboxylic acid |
CAS: |
38289-28-0 |
Synonyms: |
trans-4-ButylcyclohexanecarboxylicAcid |
IUPAC Name: | 4-butylcyclohexane-1-carboxylic acid |
Molecular Weight: | 184.27 |
Molecular Formula: | C11H20O2 |
Canonical SMILES: | CCCCC1CCC(CC1)C(=O)O |
InChI: | InChI=1S/C11H20O2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h9-10H,2-8H2,1H3,(H,12,13)/t9-,10- |
InChI Key: | BALGERHMIXFENA-MGCOHNPYSA-N |
Purity: | >98% by GC |
Appearance: | White Powder |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 |
Signal Word: | Warning |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.146329876 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.146329876 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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Related Functional Groups
Carbonyl Compounds
Cyclohexane
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