Cas no 25168-06-3 (Phenol,(1-methylethyl)-)
Phenol,(1-methylethyl)- structure
Product Name:Phenol,(1-methylethyl)-
CAS No:25168-06-3
MF:C9H12O
MW:136.190982818604
CID:270982
Update Time:2026-05-14
Phenol,(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,(1-methylethyl)-
- 4-Isopropylphenol
- ISOPROPYLPHENOL ISOMER MIXTURE
-
- Inchi： InChI=1S/C9H12O/c1-7(2)8-5-3-4-6-9(8)10/h3-7,10H,1-2H3
- InChI Key： CRBJBYGJVIBWIY-UHFFFAOYSA-N
- SMILES： CC(C1C=CC=CC=1O)C
Computed Properties
- Exact Mass: 136.08886
- Monoisotopic Mass: 136.088815
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 98.9
- 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: 2.9
- Topological Polar Surface Area: 20.2
Experimental Properties
- Density: 0.987
- Boiling Point: 208.6°C at 760 mmHg
- Flash Point: 95.3°C
- Refractive Index: 1.525
- PSA: 20.23
Phenol,(1-methylethyl)- Related Literature
-
Bo Yuan,Ze Wang,Wenli Song,Songgeng Li New J. Chem. 2019 43 8250
-
Sajal Kanti Dutta,Vishal Agarwal React. Chem. Eng. 2021 6 2315
-
Angel H. Romero,Ivan E. Romero,Lourdes Gotopo,Gustavo Cabrera,Hugo Cerecetto Mol. Syst. Des. Eng. 2023 8 358
-
4. Graphic method for the determination of the complex NMR shift and equilibrium constant for a hetero-association accompanying a self-associationJenn-Shing Chen,Jiin-Chuan Shiao J. Chem. Soc. Faraday Trans. 1994 90 429
-
Takafumi Sato,Gaku Sekiguchi,Tadafumi Adschiri,Kunio Arai Chem. Commun. 2001 1566
25168-06-3 (Phenol,(1-methylethyl)-) Related Products
- 88-60-8(2-tert-butyl-5-methylphenol)
- 89-72-5(2-Sec-Butylphenol)
- 96-70-8(2-tert-butyl-4-ethylphenol)
- 96-76-4(2,4-Di-tert-butylphenol)
- 118-82-1(4,4'-Methylenebis(2,6-DI-tert-butylphenol))
- 119-47-1(2,2'-Methylenebis(6-tert-butyl-p-cresol))
- 128-37-0(Butylated hydroxytoluene)
- 89-83-8(Thymol)
- 79-97-0(Bisphenol C)
- 128–37–0(2,6-Di-tert-butyl-4-methylphenol)
Recommended suppliers
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
鉅瀾化工科技(青島)有限公司
Gold Member
Audited Supplier
CN Supplier
Bulk
SunaTech Inc.
Gold Member
Audited Supplier
CN Supplier
Reagent
Shenzhen Yaoyuan R&D Center Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
NewCan Biotech Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
