Cas no 139517-73-0 (Boronic acid, [3-(2-hydroxyethyl)-4-methoxyphenyl]-)
139517-73-0 structure
Product Name:Boronic acid, [3-(2-hydroxyethyl)-4-methoxyphenyl]-
CAS No:139517-73-0
MF:C9H13BO4
MW:196.008123159409
CID:1273294
PubChem ID:15144150
Update Time:2025-04-20
Boronic acid, [3-(2-hydroxyethyl)-4-methoxyphenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Boronic acid, [3-(2-hydroxyethyl)-4-methoxyphenyl]-
- (3-(2-hydroxyethyl)-4-methoxyphenyl)boronic acid
- 3-(2-Hydroxyethyl)-4-methoxyphenylboronic acid
- 139517-73-0
-
- Inchi: 1S/C9H13BO4/c1-14-9-3-2-8(10(12)13)6-7(9)4-5-11/h2-3,6,11-13H,4-5H2,1H3
- InChI Key: SYUSVYAAQVDHGC-UHFFFAOYSA-N
- SMILES: O(C)C1C=CC(B(O)O)=CC=1CCO
Computed Properties
- Exact Mass: 195.09429
- Monoisotopic Mass: 196.0906891g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 165
- 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
- Topological Polar Surface Area: 69.9?2
Experimental Properties
- PSA: 69.92
Boronic acid, [3-(2-hydroxyethyl)-4-methoxyphenyl]- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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