Cas no 89403-64-5 (Benzenethiol, 4-(1,1-dimethylethyl)-3-methyl-)
89403-64-5 structure
Product Name:Benzenethiol, 4-(1,1-dimethylethyl)-3-methyl-
CAS No:89403-64-5
MF:C11H16S
MW:180.309741973877
CID:602055
PubChem ID:23037632
Update Time:2025-04-19
Benzenethiol, 4-(1,1-dimethylethyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenethiol, 4-(1,1-dimethylethyl)-3-methyl-
- 4-tert-butyl-3-methylbenzenethiol
- DTXSID70629969
- 4-tert-Butyl-3-methylbenzene-1-thiol
- SCHEMBL10333726
- 89403-64-5
-
- Inchi： 1S/C11H16S/c1-8-7-9(12)5-6-10(8)11(2,3)4/h5-7,12H,1-4H3
- InChI Key： XEQLOBCWMSSZTP-UHFFFAOYSA-N
- SMILES： SC1C=CC(=C(C)C=1)C(C)(C)C
Computed Properties
- Exact Mass: 180.09727168g/mol
- Monoisotopic Mass: 180.09727168g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 146
- 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: 3.9
- Topological Polar Surface Area: 1?2
Benzenethiol, 4-(1,1-dimethylethyl)-3-methyl- Related Literature
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
89403-64-5 (Benzenethiol, 4-(1,1-dimethylethyl)-3-methyl-) Related Products
- 100-18-5(1,4-Diisopropylbenzene)
- 159-66-0(9,9'-Spirobifluorene)
- 118-72-9(2,6-Dimethylthiophenol)
- 98-06-6(tert-Butylbenzene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 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)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
Recommended suppliers
PRIBOLAB PTE.LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Henan Dongyan Pharmaceutical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
