Cas no 61024-97-3 (Benzene, 1-bromo-5-(1,1-dimethylethyl)-2,3-dimethyl-)
61024-97-3 structure
Product Name:Benzene, 1-bromo-5-(1,1-dimethylethyl)-2,3-dimethyl-
CAS No:61024-97-3
MF:C12H17Br
MW:241.167382955551
CID:494081
PubChem ID:12307748
Update Time:2025-04-19
Benzene, 1-bromo-5-(1,1-dimethylethyl)-2,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-bromo-5-(1,1-dimethylethyl)-2,3-dimethyl-
- 1-bromo-5-tert-butyl-2,3-dimethylbenzene
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- Inchi： 1S/C12H17Br/c1-8-6-10(12(3,4)5)7-11(13)9(8)2/h6-7H,1-5H3
- InChI Key： MKOFENJYAHJXJD-UHFFFAOYSA-N
- SMILES： BrC1C(C)=C(C)C=C(C=1)C(C)(C)C
Computed Properties
- Exact Mass: 240.05141
- Monoisotopic Mass: 240.05136g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 169
- 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: 5
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1-bromo-5-(1,1-dimethylethyl)-2,3-dimethyl- Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
61024-97-3 (Benzene, 1-bromo-5-(1,1-dimethylethyl)-2,3-dimethyl-) Related Products
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