Cas no 90725-42-1 (2-Allyl-6-bromo-4-chlorophenol)
90725-42-1 structure
Product Name:2-Allyl-6-bromo-4-chlorophenol
CAS No:90725-42-1
MF:C9H8BrClO
MW:247.516221046448
CID:2156647
PubChem ID:54849040
Update Time:2025-04-21
2-Allyl-6-bromo-4-chlorophenol Chemical and Physical Properties
Names and Identifiers
-
- 2-Allyl-6-bromo-4-chlorophenol
- AKOS005352872
- SCHEMBL930281
- 90725-42-1
- HMIGMHNBRNVRGO-UHFFFAOYSA-N
- DB-251322
-
- MDL： MFCD16742711
- Inchi： 1S/C9H8BrClO/c1-2-3-6-4-7(11)5-8(10)9(6)12/h2,4-5,12H,1,3H2
- InChI Key： HMIGMHNBRNVRGO-UHFFFAOYSA-N
- SMILES： BrC1=CC(=CC(=C1O)CC=C)Cl
Computed Properties
- Exact Mass: 245.94471Da
- Monoisotopic Mass: 245.94471Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 163
- 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: 4
- Topological Polar Surface Area: 20.2?2
2-Allyl-6-bromo-4-chlorophenol Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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