Cas no 81842-17-3 (3-Cyclohexen-1-one, 4-(3-methyl-2-butenyl)-)
81842-17-3 structure
Product Name:3-Cyclohexen-1-one, 4-(3-methyl-2-butenyl)-
CAS No:81842-17-3
MF:C11H16O
MW:164.244143486023
CID:702825
PubChem ID:13213623
Update Time:2025-04-19
3-Cyclohexen-1-one, 4-(3-methyl-2-butenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Cyclohexen-1-one, 4-(3-methyl-2-butenyl)-
- 4-(3-methylbut-2-enyl)cyclohex-3-en-1-one
- 4-(3-methyl-but-2-enyl)-cyclohex-3-en-1-one
- 4-(3-methyl-2-butenyl)-3-cyclohexen-1-one
- DTXSID60528538
- 4-(3-Methylbut-2-en-1-yl)cyclohex-3-en-1-one
- 81842-17-3
-
- Inchi： 1S/C11H16O/c1-9(2)3-4-10-5-7-11(12)8-6-10/h3,5H,4,6-8H2,1-2H3
- InChI Key： MOIJEMDQURAQSW-UHFFFAOYSA-N
- SMILES： O=C1CC=C(C/C=C(\C)/C)CC1
Computed Properties
- Exact Mass: 164.120115130g/mol
- Monoisotopic Mass: 164.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 229
- 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: 2.2
- Topological Polar Surface Area: 17.1?2
3-Cyclohexen-1-one, 4-(3-methyl-2-butenyl)- Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
81842-17-3 (3-Cyclohexen-1-one, 4-(3-methyl-2-butenyl)-) Related Products
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