Cas no 16373-02-7 (Benzenemethanol, 3,5-bis(1,1-dimethylethyl)-2-hydroxy-)
16373-02-7 structure
Product Name:Benzenemethanol, 3,5-bis(1,1-dimethylethyl)-2-hydroxy-
CAS No:16373-02-7
MF:C15H24O2
MW:236.349864959717
CID:1347741
PubChem ID:526203
Update Time:2025-04-20
Benzenemethanol, 3,5-bis(1,1-dimethylethyl)-2-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 3,5-bis(1,1-dimethylethyl)-2-hydroxy-
- 2,4-ditert-butyl-6-(hydroxymethyl)phenol
- DTXSID60335587
- SCHEMBL938679
- 2-hydroxy-3,5-di-t-butylbenzyl alcohol
- SR-01000197691
- BIM-0019128.P001
- SR-01000197691-1
- AKOS000125995
- 2,4-tert-butyl-6-hydroxym ethyl-phenol
- 2,4-DI-TERT-BUTYL-6-(HYDROXYMETHYL)PHENOL
- CBMicro_019070
- CCG-5066
- CS-0336943
- STL326012
- 16373-02-7
- Oprea1_570867
- 2,4-Di-t-butyl-6-hydroxymethylphenol
-
- MDL: MFCD00441926
- Inchi: 1S/C15H24O2/c1-14(2,3)11-7-10(9-16)13(17)12(8-11)15(4,5)6/h7-8,16-17H,9H2,1-6H3
- InChI Key: JRMFJJFKLDMVQP-UHFFFAOYSA-N
- SMILES: OC1=C(CO)C=C(C=C1C(C)(C)C)C(C)(C)C
Computed Properties
- Exact Mass: 236.17772
- Monoisotopic Mass: 236.177630004g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 247
- 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: 4.6
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.46
Benzenemethanol, 3,5-bis(1,1-dimethylethyl)-2-hydroxy- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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