Cas no 71458-13-4 (CYCLOHEXANE, 1-(BROMOMETHYL)-4-BUTYL-, TRANS-)
71458-13-4 structure
Product Name:CYCLOHEXANE, 1-(BROMOMETHYL)-4-BUTYL-, TRANS-
CAS No:71458-13-4
MF:C11H21Br
MW:233.18844294548
CID:3412505
PubChem ID:18792307
Update Time:2025-04-21
CYCLOHEXANE, 1-(BROMOMETHYL)-4-BUTYL-, TRANS- Chemical and Physical Properties
Names and Identifiers
-
- CYCLOHEXANE, 1-(BROMOMETHYL)-4-BUTYL-, TRANS-
- SCHEMBL7913395
- 192123-09-4
- DTXSID901277324
- AKOS008967260
- 71458-13-4
- trans-1-(Bromomethyl)-4-butylcyclohexane
- SCHEMBL7751705
- 1-(bromomethyl)-4-butylcyclohexane
- EN300-675190
-
- Inchi： 1S/C11H21Br/c1-2-3-4-10-5-7-11(9-12)8-6-10/h10-11H,2-9H2,1H3/t10-,11-
- InChI Key： MVMZKLKIUWBNCA-XYPYZODXSA-N
- SMILES： [C@@H]1(CBr)CC[C@@H](CCCC)CC1
Computed Properties
- Exact Mass: 232.08266Da
- Monoisotopic Mass: 232.08266Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 104
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 0?2
CYCLOHEXANE, 1-(BROMOMETHYL)-4-BUTYL-, TRANS- Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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