Cas no 100960-70-1 (Pentanoic acid, 2-bromo-2-ethyl-)
100960-70-1 structure
Product Name:Pentanoic acid, 2-bromo-2-ethyl-
CAS No:100960-70-1
MF:C7H13BrO2
MW:209.080921888351
CID:1127598
Update Time:2024-07-27
Pentanoic acid, 2-bromo-2-ethyl- Chemical and Physical Properties
Names and Identifiers
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- Pentanoic acid, 2-bromo-2-ethyl-
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- Inchi： 1S/C7H13BrO2/c1-3-5-7(8,4-2)6(9)10/h3-5H2,1-2H3,(H,9,10)
- InChI Key： MUDRYEDQTYYYCT-UHFFFAOYSA-N
- SMILES： C(O)(=O)C(Br)(CC)CCC
Computed Properties
- Exact Mass: 208.00989
Experimental Properties
- Density: 1.376±0.06 g/cm3(Predicted)
- Boiling Point: 257.7±13.0 °C(Predicted)
- PSA: 37.3
- pka: 3.01±0.40(Predicted)
Pentanoic acid, 2-bromo-2-ethyl- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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