Cas no 56985-74-1 (Propanoic acid,2-bromo-, sodium salt (1:1))
56985-74-1 structure
Product Name:Propanoic acid,2-bromo-, sodium salt (1:1)
CAS No:56985-74-1
MF:C3H4BrNaO2
MW:174.956431388855
CID:375386
PubChem ID:23695984
Update Time:2025-04-19
Propanoic acid,2-bromo-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,2-bromo-, sodium salt (1:1)
- sodium 2-bromopropionate
- sodium,2-bromopropanoate
- (+-)-2-bromo-propionic acid,sodium salt
- 2-Bromopropanoic acid sodium salt
- bromo-2 propionate de sodium
- EINECS 260-501-7
- Propanoic acid,2-bromo-,sodium salt
- Propionic acid,2-bromo-,sodium salt
- NS00087301
- Propanoic acid, 2-bromo-, sodium salt
- sodium;2-bromopropanoate
- NHEFSTXHZRGAIH-UHFFFAOYSA-M
- Sodium 2-bromopropanoate
- SCHEMBL128117
- 56985-74-1
- Sodium alpha-bromopropionate
- Propionic acid, 2-bromo-, sodium salt
- DTXSID00972470
-
- Inchi： 1S/C3H5BrO2.Na/c1-2(4)3(5)6;/h2H,1H3,(H,5,6);/q;+1/p-1
- InChI Key： NHEFSTXHZRGAIH-UHFFFAOYSA-M
- SMILES： BrC(C(=O)[O-])C.[Na+]
Computed Properties
- Exact Mass: 173.92900
- Monoisotopic Mass: 173.92924g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 1
- Complexity: 66
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.1?2
Experimental Properties
- PSA: 40.13000
- LogP: -0.48030
Propanoic acid,2-bromo-, sodium salt (1:1) Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at recommended temperature
Propanoic acid,2-bromo-, sodium salt (1:1) Related Literature
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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