Cas no 5440-19-7 (Tris(2-cyclohexylcyclohexyl) Borate)
5440-19-7 structure
Product Name:Tris(2-cyclohexylcyclohexyl) Borate
CAS No:5440-19-7
MF:C36H63BO3
MW:554.694631814957
CID:941071
PubChem ID:21581
Update Time:2025-04-19
Tris(2-cyclohexylcyclohexyl) Borate Chemical and Physical Properties
Names and Identifiers
-
- Tris(2-cyclohexylcyclohexyl) Borate
- Boric acid tris(2-cyclohexylcyclohexyl) ester
- (Bicyclohexyl)-2-ol, triester with boric acid (H3BO3)
- [Bicyclohexyl]-2-ol, triester with boric acid (H3BO3)
- AC1L2IN1
- boric acid tris-(cis-bicyclohexyl-2-yl ester)
- Borsaeure-tris-(cis-bicyclohexyl-2-ylester)
- BRN 3715400
- CTK8J1590
- SureCN723345
- Tri(2-cyclohexylcyclohexyl)borate
- DTXSID50969532
- 4-06-00-00316 (Beilstein Handbook Reference)
- NSC-15195
- BORIC ACID, TRIS(2-CYCLOHEXYLCYCLOHEXYL) ESTER
- (1,1'-Bicyclohexyl)-2-ol, triester with boric acid (H3BO3)
- WLN: L6TJ A- AL6TJ BOBO- AL6TJ B- AL6TJ&&O- AL6TJ B- AL6TJ
- NSC 15195
- [1, triester with boric acid (H3BO3)
- Tri[1,1'-bi(cyclohexane)]-2-yl borate
- 5440-19-7
- AKOS024429994
- SCHEMBL723345
- NSC15195
-
- MDL： MFCD00021277
- Inchi： 1S/C36H63BO3/c1-4-16-28(17-5-1)31-22-10-13-25-34(31)38-37(39-35-26-14-11-23-32(35)29-18-6-2-7-19-29)40-36-27-15-12-24-33(36)30-20-8-3-9-21-30/h28-36H,1-27H2
- InChI Key： SFCBPVBDIBWEJM-UHFFFAOYSA-N
- SMILES： O(B(OC1CCCCC1C1CCCCC1)OC1CCCCC1C1CCCCC1)C1CCCCC1C1CCCCC1
Computed Properties
- Exact Mass: 553.49089
- Monoisotopic Mass: 554.4870260g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 40
- Rotatable Bond Count: 9
- Complexity: 618
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 6
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- Melting Point: 173.5°C
- PSA: 27.69
Tris(2-cyclohexylcyclohexyl) Borate Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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