Cas no 403615-64-5 (Cyclohexanecarbonitrile,1-acetyl-)
403615-64-5 structure
Product Name:Cyclohexanecarbonitrile,1-acetyl-
CAS No:403615-64-5
MF:C9H13NO
MW:151.205622434616
CID:325926
PubChem ID:18340732
Update Time:2025-04-19
Cyclohexanecarbonitrile,1-acetyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarbonitrile,1-acetyl-
- Cyclohexanecarbonitrile, 1-acetyl- (9CI)
- SCHEMBL24663502
- 403615-64-5
- 1-acetylcyclohexane-1-carbonitrile
- AT30361
- Cyclohexanecarbonitrile,1-acetyl-(9ci)
-
- Inchi： 1S/C9H13NO/c1-8(11)9(7-10)5-3-2-4-6-9/h2-6H2,1H3
- InChI Key： VUEOHKDCADKHJQ-UHFFFAOYSA-N
- SMILES： O=C(C)C1(C#N)CCCCC1
Computed Properties
- Exact Mass: 151.099714038g/mol
- Monoisotopic Mass: 151.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 205
- 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: 1.8
- Topological Polar Surface Area: 40.9?2
Cyclohexanecarbonitrile,1-acetyl- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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