Cas no 16308-82-0 (Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl-)
16308-82-0 structure
Product Name:Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl-
CAS No:16308-82-0
MF:C10H12O4
MW:196.199883460999
CID:1346169
PubChem ID:19881764
Update Time:2025-04-20
Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl-
- 2,4-dihydroxy-3,5,6-trimethylbenzoic acid
- Q27225434
- SCHEMBL274096
- AKOS030587687
- CHEBI:132131
- MEGxm0_000189
- CCG-261986
- USF 406B
- 16308-82-0
- 3,5-dimethylorsellinic acid
- DTXSID60600969
- starbld0019509
-
- Inchi： 1S/C10H12O4/c1-4-5(2)8(11)6(3)9(12)7(4)10(13)14/h11-12H,1-3H3,(H,13,14)
- InChI Key： NZGSNQJCTOMELT-UHFFFAOYSA-N
- SMILES： OC1=C(C)C(=C(C(=O)O)C(C)=C1C)O
Computed Properties
- Exact Mass: 196.07355886g/mol
- Monoisotopic Mass: 196.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 228
- 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: 2.4
- Topological Polar Surface Area: 77.8?2
Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl- Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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4. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
16308-82-0 (Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl-) Related Products
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