(2,5-Dimethyl-benzenesulfonylamino)-acetic acid

Base Information

• Chemical Name: (2,5-Dimethyl-benzenesulfonylamino)-acetic acid
• CAS No.: 13240-18-1
• Molecular Formula: C10H13NO4S
• Molecular Weight: 243.28
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID50353891
• Wikidata: Q82131728
• Mol file: 13240-18-1.mol

Synonyms:13240-18-1;(2,5-Dimethyl-benzenesulfonylamino)-acetic acid;N-[(2,5-Dimethylphenyl)sulfonyl]glycine;2-[(2,5-dimethylphenyl)sulfonylamino]acetic acid;2-(2,5-dimethylbenzenesulfonamido)acetic acid;MFCD03658020;2-(2,5-Dimethylphenylsulfonamido)acetic acid;N-(2,5-Dimethylbenzene-1-sulfonyl)glycine;Glycine, N-(2,5-xylylsulfonyl)- (7CI,8CI);AE-641/42121831;2-{[(2,5-dimethylphenyl)sulfonyl]amino}acetic acid;DTXSID50353891;AKOS000273342;N-(2,5-Dimethylphenylsulfonyl)glycine;HY-W031074;NCGC00342300-01;AS-65241;2-(2,5-Dimethylphenylsulfonamido)aceticacid;CS-0075098;EU-0016852;EN300-05715;2-(2,5-Dimethylphenylsulfonylamino)acetic acid;AB00333253-03;{[(2,5-dimethylphenyl)sulfonyl]amino}acetic acid;(2,5-DIMETHYL-BENZENESULFONYLAMINO)-ACETICACID;Z45658572;F1414-0611

Chemical Property of (2,5-Dimethyl-benzenesulfonylamino)-acetic acid

Chemical Property:

• Vapor Pressure: 5.66E-09mmHg at 25°C
• Melting Point: 130-131℃
• Refractive Index: 1.559
• Boiling Point: 452.4 °C at 760 mmHg
• PKA: 3.32±0.10(Predicted)
• Flash Point: 227.4 °C
• PSA: 91.85000
• Density: 1.324g/cm³
• LogP: 2.13800
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 243.05652907
• Heavy Atom Count: 16
• Complexity: 346

Purity/Quality:

99% ^*data from raw suppliers

2-(2,5-Dimethylbenzenesulfonamido)aceticAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(=O)O