Cas no 62512-77-0 (Benzoic acid, 5-(chloromethyl)-2-hydroxy-, phenyl ester)
62512-77-0 structure
Product Name:Benzoic acid, 5-(chloromethyl)-2-hydroxy-, phenyl ester
CAS No:62512-77-0
MF:C14H11ClO3
MW:262.688343286514
CID:442158
PubChem ID:71385701
Update Time:2025-04-19
Benzoic acid, 5-(chloromethyl)-2-hydroxy-, phenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 5-(chloromethyl)-2-hydroxy-, phenyl ester
- phenyl 5-(chloromethyl)-2-hydroxybenzoate
- DTXSID50807920
- 62512-77-0
-
- Inchi： 1S/C14H11ClO3/c15-9-10-6-7-13(16)12(8-10)14(17)18-11-4-2-1-3-5-11/h1-8,16H,9H2
- InChI Key： FVKJWHHMEYNNJT-UHFFFAOYSA-N
- SMILES： ClCC1C=CC(=C(C(=O)OC2C=CC=CC=2)C=1)O
Computed Properties
- Exact Mass: 262.03973
- Monoisotopic Mass: 262.0396719g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 276
- 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: 4.2
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Benzoic acid, 5-(chloromethyl)-2-hydroxy-, phenyl ester Related Literature
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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