Cas no 148529-40-2 (Benzoic acid, 2-hydroxy-6-octyl-)
148529-40-2 structure
Product Name:Benzoic acid, 2-hydroxy-6-octyl-
CAS No:148529-40-2
MF:C15H22O3
MW:250.333384990692
CID:1319775
Update Time:2024-08-18
Benzoic acid, 2-hydroxy-6-octyl- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2-hydroxy-6-octyl-
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- Inchi： 1S/C15H22O3/c1-2-3-4-5-6-7-9-12-10-8-11-13(16)14(12)15(17)18/h8,10-11,16H,2-7,9H2,1H3,(H,17,18)
- InChI Key： URXCFPXNCPBEJA-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=C(CCCCCCCC)C=CC=C1O
Computed Properties
- Exact Mass: 250.15696
Experimental Properties
- Density: 1.077±0.06 g/cm3(Predicted)
- Boiling Point: 383.1±30.0 °C(Predicted)
- PSA: 57.53
- pka: 3.09±0.30(Predicted)
Benzoic acid, 2-hydroxy-6-octyl- Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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