Cas no 89368-24-1 (Phenol, 2-bromo-6-methyl-3-(1-methylethyl)-)
89368-24-1 structure
Product Name:Phenol, 2-bromo-6-methyl-3-(1-methylethyl)-
CAS No:89368-24-1
MF:C10H13BrO
MW:229.113622426987
CID:603058
PubChem ID:69849717
Update Time:2025-04-19
Phenol, 2-bromo-6-methyl-3-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 2-bromo-6-methyl-3-(1-methylethyl)-
- 2-bromo-6-methyl-3-propan-2-ylphenol
- DTXSID30741419
- 89368-24-1
- 2-Bromo-6-methyl-3-(propan-2-yl)phenol
- SCHEMBL6643437
-
- Inchi： 1S/C10H13BrO/c1-6(2)8-5-4-7(3)10(12)9(8)11/h4-6,12H,1-3H3
- InChI Key： MUYGMRSEWJQXJU-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C)C=CC=1C(C)C)O
Computed Properties
- Exact Mass: 228.01498g/mol
- Monoisotopic Mass: 228.01498g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 147
- 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: 3.7
- Topological Polar Surface Area: 20.2?2
Phenol, 2-bromo-6-methyl-3-(1-methylethyl)- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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