Cas no 34942-91-1 (3-Hepten-1-ol,1-acetate)
3-Hepten-1-ol,1-acetate structure
Product Name:3-Hepten-1-ol,1-acetate
CAS No:34942-91-1
MF:C9H16O2
MW:156.222143173218
CID:295227
Update Time:2024-01-27
3-Hepten-1-ol,1-acetate Chemical and Physical Properties
Names and Identifiers
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- 3-Hepten-1-ol,1-acetate
- 3-Hepten-1-ol,acetate (7CI,9CI)
- 3-Hepten-1-yl acetate
- 3-Heptenyl acetate
- TRANS-3-HEPTENYLACETATE
- 3-Heptenyl=acetate
- 3-Hepten-1-ol, 1-acetate
-
- Inchi： 1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h5-6H,3-4,7-8H2,1-2H3
- InChI Key： AAYIYWGTGAUKQY-UHFFFAOYSA-N
- SMILES： C(OC(=O)C)CC=CCCC
Computed Properties
- Exact Mass: 174.12564
Experimental Properties
- Density: 0.896±0.06 g/cm3(Predicted)
- Boiling Point: 86-89 °C(Press: 29 Torr)
- PSA: 57.53
3-Hepten-1-ol,1-acetate Related Literature
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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