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Cholesteryl benzoate - 96%, high purity , CAS No.604-32-0

≥96%

CAS#: 604-32-0
Molecular Weight: 490.76
Beilstein Registry Number: 3225829
EC Number: 210-064-3
MDL number: MFCD00003635
PubChem CID: 2723613
PubChem SID: 488192162

In stock

Item Number

C113813

Grouped product items
SKU	Size	Availability	Price
C113813-5g	5g	7	$12.90
C113813-25g	25g	1	$49.90
C113813-100g	100g	1	$172.90

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Cholesteric liquid crystals (0)

Basic Description

Synonyms	Cholest-5-en-3-yl benzoate # \| 5-Cholesten-3.beta.-ol benzoate \| Cholesteryl benzoate, 98% \| Q-200844 \| Cholest-5-en-3-ol (3beta)-, benzoate \| 3b-(Benzoyloxy)cholest-5-ene \| J-640214 \| 5-CHOLESTEN-3-YL BENZOATE \| [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl
Specifications & Purity	≥96%
Shipped In	Normal
Product Description	An emulsifying agent

Names and Identifiers

Pubchem Sid	488192162
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488192162
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate
INCHI	InChI=1S/C34H50O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3/t24-,27+,28+,29-,30+,31+,33+,34-/m1/s1
InChi Key	UVZUFUGNHDDLRQ-LLHZKFLPSA-N
Canonical SMILES	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C5=CC=CC=C5)C)C
Isomeric SMILES	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C5=CC=CC=C5)C)C
WGK Germany	3
PubChem CID	2723613
Molecular Weight	490.76
Beilstein	3225829
Reaxy-Rn	3225829

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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12 results found

Lot Number	Certificate Type	Date	Item
A2417255	Certificate of Analysis	Jan 05, 2024	C113813
A2417256	Certificate of Analysis	Jan 05, 2024	C113813
A2417257	Certificate of Analysis	Jan 05, 2024	C113813
A2417258	Certificate of Analysis	Jan 05, 2024	C113813
A2417259	Certificate of Analysis	Jan 05, 2024	C113813
A2417260	Certificate of Analysis	Jan 05, 2024	C113813
D2304482	Certificate of Analysis	Feb 27, 2023	C113813
D2306007	Certificate of Analysis	Feb 27, 2023	C113813
D2306006	Certificate of Analysis	Feb 27, 2023	C113813
D2306011	Certificate of Analysis	Feb 27, 2023	C113813
D2306013	Certificate of Analysis	Feb 27, 2023	C113813
D2306010	Certificate of Analysis	Feb 27, 2023	C113813

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Chemical and Physical Properties

Specific Rotation[α]	-10° (C=5,THF)
Melt Point(°C)	149-151°C
Molecular Weight	490.800 g/mol
XLogP3	10.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	8
Exact Mass	490.381 Da
Monoisotopic Mass	490.381 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	36
Formal Charge	0
Complexity	806.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Safety and Hazards(GHS)

WGK Germany	3
Reaxy-Rn	3225829

References

1. S Pal,S P Moulik. (1984-02-01) Solubility of cholesterol & cholesteryl benzoate in some polar & nonpolar organic solvents.. Indian journal of biochemistry & biophysics, 21 ((1)): (12-16). [PMID:6490054]
2. S Pal,S P Moulik. (1984-02-01) Solubility of cholesterol in bile salt-synthetic detergent mixed micelles & that of cholesteryl benzoate in synthetic detergent mixed micelles.. Indian journal of biochemistry & biophysics, 21 ((1)): (17-22). [PMID:6490055]
3. I G Gertsen,A A Lobenko,A L Tsykalo. (1981-02-01) [Use of liquid-crystal cutaneous thermography for the diagnosis of bone diseases].. Ortopediia travmatologiia i protezirovanie, ((2)(2)): (66-69). [PMID:7231944]
4. Ramina Nabiee,Barent Dubois,Laura Green,Ajay Sharma,Siu Fun Wong,Hamidreza Montazeri Aliabadi. (2018-10-06) In vitro and ex-vivo evaluation of topical formulations designed to minimize transdermal absorption of Vitamin K1.. PloS one, 13 ((10)): (e0204531-e0204531). [PMID:30289881]
5. M L Das,P K Bhattacharya,S P Moulik. (1989-02-01) Model biological microemulsions: Part I--Phase behaviour and physicochemical properties of cholesteryl benzoate and sodium deoxycholate contained microemulsions.. Indian journal of biochemistry & biophysics, 26 ((1)): (24-29). [PMID:2777310]
6. Zhen Huang,Mei Feng,Junfeng Su,Yuhua Guo,Tie-Yan Liu,Yee C Chiew. (2010-07-27) Influence of supercritical CO(2) pressurization on the phase behavior of mixed cholesteryl esters.. International journal of pharmaceutics, 397 ((1-2)): (130-135). [PMID:20654706]

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