Cas no 321547-13-1 (Phenol,3-ethyl-5-(1-methylethyl)-)
321547-13-1 structure
Product Name:Phenol,3-ethyl-5-(1-methylethyl)-
CAS No:321547-13-1
MF:C11H16O
MW:164.244143486023
CID:301341
PubChem ID:23162381
Update Time:2025-04-19
Phenol,3-ethyl-5-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,3-ethyl-5-(1-methylethyl)-
- Phenol, 3-ethyl-5-(1-methylethyl)- (9CI)
- 3-ethyl-5-propan-2-ylphenol
- Phenol,3-ethyl-5-(1-methylethyl)-(9ci)
- MB23668
- SCHEMBL5165441
- 321547-13-1
- 3-ETHYL-5-(1-METHYLETHYL)-PHENOL
-
- Inchi： 1S/C11H16O/c1-4-9-5-10(8(2)3)7-11(12)6-9/h5-8,12H,4H2,1-3H3
- InChI Key： ODIDHZTUNRNUMX-UHFFFAOYSA-N
- SMILES： OC1C=C(CC)C=C(C=1)C(C)C
Computed Properties
- Exact Mass: 164.12018
- Monoisotopic Mass: 164.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 131
- 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: 3.5
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Phenol,3-ethyl-5-(1-methylethyl)- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
321547-13-1 (Phenol,3-ethyl-5-(1-methylethyl)-) Related Products
- 3228-03-3(5-Isopropyl-3-methylphenol)
- 1197-34-8(Phenol, 3,5-diethyl-)
- 1988-89-2(Phenol,4-(1-phenylethyl)-)
- 698-71-5(3-Ethyl-5-methylphenol)
- 620-17-7(3-Ethylphenol)
- 1138-52-9(3,5-Di-tert-butylphenol)
- 603-44-1(4-Bis(4-hydroxyphenyl)methylphenol)
- 585-34-2(3-Tert-Butylphenol)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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