Cas no 81676-11-1 (BENZENE, 1-METHYL-4-(1-METHYL-1-PROPENYL)-)
81676-11-1 structure
Product Name:BENZENE, 1-METHYL-4-(1-METHYL-1-PROPENYL)-
CAS No:81676-11-1
MF:C11H14
MW:146.228863239288
CID:3369228
PubChem ID:14193708
Update Time:2025-04-21
BENZENE, 1-METHYL-4-(1-METHYL-1-PROPENYL)- Chemical and Physical Properties
Names and Identifiers
-
- BENZENE, 1-METHYL-4-(1-METHYL-1-PROPENYL)-
- 81676-11-1
- DTXSID901020818
- 1-[(E)-but-2-en-2-yl]-4-methylbenzene
-
- Inchi： 1S/C11H14/c1-4-10(3)11-7-5-9(2)6-8-11/h4-8H,1-3H3/b10-4+
- InChI Key： DXUWNFYPTIECOG-ONNFQVAWSA-N
- SMILES： C1(C=CC(C)=CC=1)/C(=C/C)/C
Computed Properties
- Exact Mass: 146.109550447g/mol
- Monoisotopic Mass: 146.109550447g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 136
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.9
- Topological Polar Surface Area: 0?2
BENZENE, 1-METHYL-4-(1-METHYL-1-PROPENYL)- Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
81676-11-1 (BENZENE, 1-METHYL-4-(1-METHYL-1-PROPENYL)-) Related Products
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