1-Decalone,mixture of cis and trans - CAS 4832-16-0
Catalog: |
BB026517 |
Product Name: |
1-Decalone,mixture of cis and trans |
CAS: |
4832-16-0 |
Synonyms: |
3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-one |
IUPAC Name: | 3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-one |
Description: | 1-Decalone,mixture of cis and trans (CAS# 4832-16-0) is a useful research chemical. |
Molecular Weight: | 152.23 |
Molecular Formula: | C10H16O |
Canonical SMILES: | C1CCC2C(C1)CCCC2=O |
InChI: | InChI=1S/C10H16O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h8-9H,1-7H2 |
InChI Key: | AFEFRXAPJRCTOW-UHFFFAOYSA-N |
Boiling Point: | 73-75 °C1 mmHg (lit.) |
Purity: | 95 % |
Density: | 0.986 g/mL at 25°C(lit.) |
Appearance: | Liquid |
MDL: | MFCD00001697 |
LogP: | 2.54580 |
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 |
CN-112940959-A | Klebsiella capable of degrading limonene and application thereof | 20201204 |
WO-2020187877-A1 | Isomerisation reaction | 20190321 |
CN-112805266-A | Isomerization reaction | 20190321 |
EP-3837235-A1 | Isomerisation reaction | 20190321 |
WO-2019188432-A1 | Resin composition and electronic component | 20180330 |
PMID | Publication Date | Title | Journal |
21806053 | 20111007 | Spectroscopic and X-ray crystallographic evidence for electrostatic effects in 4-substituted cyclohexanone-derived hydrazones, imines, and corresponding salts | The Journal of organic chemistry |
21200898 | 20071221 | (4aS,5R,7R,8S,8aR)-8-(1,3-Dioxolan-2-yl)-7,8-dimethyl-5-(1-methyl-ethen-yl)perhydro-naphthalen-2-one | Acta crystallographica. Section E, Structure reports online |
17388570 | 20070424 | Solution structure of a designed spirocyclic helical ligand binding at a two-base bulge site in DNA | Biochemistry |
16638534 | 20060301 | High-throughput mutagenesis to evaluate models of stereochemical control in ketoreductase domains from the erythromycin polyketide synthase | Chemistry & biology |
12660358 | 20030401 | Single administration toxicokinetic studies of decalin (decahydronaphthalene) in rats and mice | Toxicological sciences : an official journal of the Society of Toxicology |
Complexity: | 162 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.120115130 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.120115130 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
-
Catalog: BB032683
(-)-Dipivaloyl-L-tartaric Acid
Detail
-
Catalog: BB010000
(+)-3-Bromocamphor-8-sulfonic Acid Ammonium Salt
Detail
-
Catalog: BB027076
(±)-Diethyl trans-4-cyclohexene-1,2-dicarboxylate
Detail
-
Catalog: BB010056
(±)-cis-Cyclopentane-1,2-dicarboxylic acid
Detail
-
Catalog: BB028257
(±)-2-Acetoxypropionic acid
Detail
-
Catalog: BB009173
(+/-)-trans-Oxirane-2,3-dicarboxylic acid
Detail
-
Catalog: BB015442
(±)-8a-Methyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione
Detail
-
Catalog: BB033577
(-)-2,3:4,6-Di-O-isopropylidene-2-keto-L-gulonic Acid Monohydrate
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS