Cas no 58567-80-9 (Benzene, 1-(1,1-dimethylethyl)-4-propyl-)
58567-80-9 structure
Product Name:Benzene, 1-(1,1-dimethylethyl)-4-propyl-
CAS No:58567-80-9
MF:C13H20
MW:176.297904014587
CID:341621
PubChem ID:12354204
Update Time:2025-04-19
Benzene, 1-(1,1-dimethylethyl)-4-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-(1,1-dimethylethyl)-4-propyl-
- 1-tert-butyl-4-propylbenzene
- DTXSID20493596
- 58567-80-9
- 1-tert-butyl-4-propyl-benzene
-
- Inchi： 1S/C13H20/c1-5-6-11-7-9-12(10-8-11)13(2,3)4/h7-10H,5-6H2,1-4H3
- InChI Key： XLJCEWXIEVXDCP-UHFFFAOYSA-N
- SMILES： C(C)(C)(C)C1C=CC(=CC=1)CCC
Computed Properties
- Exact Mass: 176.1566
- Monoisotopic Mass: 176.156500638g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 133
- 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: 4.9
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1-(1,1-dimethylethyl)-4-propyl- Related Literature
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
58567-80-9 (Benzene, 1-(1,1-dimethylethyl)-4-propyl-) Related Products
- 1014-60-4(1,3-Di-tert-butylbenzene)
- 1012-72-2(1,4-Di-tert-butylbenzene)
- 2049-95-8(Tert-Pentylbenzene)
- 1460-02-2(1,3,5-Tri-tert-butylbenzene)
- 873-49-4(Cyclopropylbenzene)
- 98-19-1(1-tert-Butyl-3,5-dimethylbenzene)
- 15181-11-0(3,5-Di-tert-butyltoluene)
- 1075-38-3(3-Tert-Butyltoluene)
- 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)
Recommended suppliers
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent
Nanjing Jubai Biopharm
Gold Member
Audited Supplier
CN Supplier
Bulk
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
