Cas no 108791-60-2 (2-bromo-3-hydroxy-5-methoxybenzaldehyde)
108791-60-2 structure
Product Name:2-bromo-3-hydroxy-5-methoxybenzaldehyde
CAS No:108791-60-2
MF:C8H7BrO3
MW:231.043381929398
CID:1186933
PubChem ID:13737637
Update Time:2025-04-20
2-bromo-3-hydroxy-5-methoxybenzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 2-bromo-3-hydroxy-5-methoxybenzaldehyde
- 108791-60-2
- DTXSID70548045
-
- Inchi： 1S/C8H7BrO3/c1-12-6-2-5(4-10)8(9)7(11)3-6/h2-4,11H,1H3
- InChI Key： GFJBSJRHENOLOW-UHFFFAOYSA-N
- SMILES： BrC1C(=CC(=CC=1C=O)OC)O
Computed Properties
- Exact Mass: 229.95781
- Monoisotopic Mass: 229.95786g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 162
- 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: 1.7
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
2-bromo-3-hydroxy-5-methoxybenzaldehyde 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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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
108791-60-2 (2-bromo-3-hydroxy-5-methoxybenzaldehyde) Related Products
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