3-Amino-3-(2-chloro-5-nitrophenyl)propanoic acid

Base Information

• Chemical Name: 3-Amino-3-(2-chloro-5-nitrophenyl)propanoic acid
• CAS No.: 282524-74-7
• Molecular Formula: C9H9 Cl N2 O4
• Molecular Weight: 244.63
• DSSTox Substance ID: DTXSID00403350
• Mol file: 282524-74-7.mol

Synonyms:282524-74-7;3-amino-3-(2-chloro-5-nitrophenyl)propanoic acid;Benzenepropanoic acid, b-amino-2-chloro-5-nitro-;3-Amino-3-(2-chloro-5-nitro-phenyl)-propionic acid;DTXSID00403350;MFCD01871298;STK682548;AKOS001730270;CS-0268701;EN300-1983073;2,4-DIHYDROXY-6-METHYLPYRIDINE-3-CARBOXYLICACID

Chemical Property of 3-Amino-3-(2-chloro-5-nitrophenyl)propanoic acid

Chemical Property:

• PSA: 109.14000
• LogP: 2.94620
• XLogP3: -1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 244.0250845
• Heavy Atom Count: 16
• Complexity: 281

Purity/Quality:

98.5% ^*data from raw suppliers

3-Amino-3-(2-chloro-5-nitro-phenyl)-propionicacid 95 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(CC(=O)O)N)Cl