Cas no 74515-15-4 (Phenol, 4-chloro-2,6-bis(1-methylcyclopentyl)-)
74515-15-4 structure
Product Name:Phenol, 4-chloro-2,6-bis(1-methylcyclopentyl)-
CAS No:74515-15-4
MF:C18H25ClO
MW:292.843504667282
CID:540887
PubChem ID:71403968
Update Time:2025-04-19
Phenol, 4-chloro-2,6-bis(1-methylcyclopentyl)- Chemical and Physical Properties
Names and Identifiers
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- Phenol, 4-chloro-2,6-bis(1-methylcyclopentyl)-
- 4-chloro-2,6-bis(1-methylcyclopentyl)phenol
- DTXSID60824840
- 74515-15-4
-
- Inchi: 1S/C18H25ClO/c1-17(7-3-4-8-17)14-11-13(19)12-15(16(14)20)18(2)9-5-6-10-18/h11-12,20H,3-10H2,1-2H3
- InChI Key: HPBRWMNHKDYVGV-UHFFFAOYSA-N
- SMILES: ClC1C=C(C(=C(C=1)C1(C)CCCC1)O)C1(C)CCCC1
Computed Properties
- Exact Mass: 292.1593931g/mol
- Monoisotopic Mass: 292.1593931g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 309
- 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: 7.3
- Topological Polar Surface Area: 20.2?2
Phenol, 4-chloro-2,6-bis(1-methylcyclopentyl)- Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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