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4-Oxo-L-proline hydrobromide

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Name

4-Oxo-L-proline hydrobromide

EINECS N/A
CAS No. 75776-67-9 Density 1.38g/cm3
PSA 66.40000 LogP 0.28890
Solubility N/A Melting Point 154-156 °C
Formula C5H7NO3.HBr Boiling Point 341.8oC at 760mmHg
Molecular Weight 210.027 Flash Point 160.5oC
Transport Information N/A Appearance N/A
Safety 26-39 Risk Codes 37/38-41
Molecular Structure Molecular Structure of 75776-67-9 (4-keto-L-proline hydrobromide) Hazard Symbols Xi
Synonyms

4-keto-L-proline hydrobromide;

Article Data 2

4-Oxo-L-proline hydrobromide Specification

The 4-Oxo-L-proline hydrobromide is an organic compound with the formula C5H7NO3.HBr. The IUPAC name of this chemical is (2S)-4-oxopyrrolidine-2-carboxylic acid hydrobromide. With the CAS registry number 75776-67-9, it is also named as L-Proline, 4-oxo-, hydrobromide (1:1).

Physical properties about 4-Oxo-L-proline hydrobromide are: (1)H-Bond Donor: 2; (2)H-Bond Acceptor: 4; (3)Rotatable Bond Count: 1; (4)Tautomer Count: 3; (5)Exact Mass: 208.968756; (6)MonoIsotopic Mass: 208.968756; (7)Topological Polar Surface Area: 66.4; (8)Heavy Atom Count: 10; (9)Complexity: 154; (10)Defined Atom StereoCenter Count: 1; (11)Covalently-Bonded Unit Count: 2.

You can still convert the following datas into molecular structure:
(1)SMILES: C1[C@H](NCC1=O)C(=O)O.Br
(2)InChI: InChI=1/C5H7NO3.BrH/c7-3-1-4(5(8)9)6-2-3;/h4,6H,1-2H2,(H,8,9);1H/t4-;/m0./s1
(3)InChIKey: SFSROLZHCPCODJ-WCCKRBBIBN
(4)Std. InChI: InChI=1S/C5H7NO3.BrH/c7-3-1-4(5(8)9)6-2-3;/h4,6H,1-2H2,(H,8,9);1H/t4-;/m0./s1
(5)Std. InChIKey: SFSROLZHCPCODJ-WCCKRBBISA-N

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