Glycine, N-benzoyl-,ammonium salt (1:1) supplier

Name
AMMONIUM HIPPURATE
EINECS 208-547-9
CAS No. 532-93-4
Density
Solubility
Melting Point
Formula C₉H₁₂N₂O₃
Boiling Point 464.1 °C at 760 mmHg
Molecular Weight 196.2
Flash Point 234.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Glycine,N-benzoyl-, monoammonium salt (9CI);Hippuric acid, monoammonium salt (8CI);Ammonium hippurate;
PSA 69.64000
LogP 1.21580

Glycine, N-benzoyl-,ammonium salt (1:1) Specification

The Glycine, N-benzoyl-, ammonium salt (1:1), with the CAS registry number 532-93-4, is also known as Ammonium (benzoylamino)acetate. Its EINECS registry number is 208-547-9. This chemical's molecular formula is C₉H₁₂N₂O₃ and molecular weight is 196.2. What's more, its IUPAC name is Azane; 2-benzamidoacetic acid.

Physical properties about Glycine, N-benzoyl-, ammonium salt (1:1) are: (1)ACD/LogP: 0.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.61; (4)ACD/LogD (pH 7.4): -3.17; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.61 Å²; (13)Flash Point: 234.5 °C; (14)Enthalpy of Vaporization: 76.44 kJ/mol; (15)Boiling Point: 464.1 °C at 760 mmHg; (16)Vapour Pressure: 2.06E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(NCC(=O)O)c1ccccc1.N
(2) InChI: InChI=1/C9H9NO3.H3N/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;/h1-5H,6H2,(H,10,13)(H,11,12);1H3
(3) InChIKey: RXBWNIYFOFYPJR-UHFFFAOYAG

Product Name

AMMONIUM HIPPURATE

Glycine, N-benzoyl-,ammonium salt (1:1) Specification

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