Home Nitros 4-Chloro-2-nitro-DL-phenylalanine

4-Chloro-2-nitro-DL-phenylalanine

CAS No.:
56433-05-7
Catalog Number:
AG003L43
Molecular Formula:
C9H9ClN2O4
Molecular Weight:
244.6318
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Product Description
Catalog Number:
AG003L43
Chemical Name:
4-Chloro-2-nitro-DL-phenylalanine
CAS Number:
56433-05-7
Molecular Formula:
C9H9ClN2O4
Molecular Weight:
244.6318
MDL Number:
MFCD09914877
IUPAC Name:
2-amino-3-(4-chloro-2-nitrophenyl)propanoic acid
InChI:
InChI=1S/C9H9ClN2O4/c10-6-2-1-5(3-7(11)9(13)14)8(4-6)12(15)16/h1-2,4,7H,3,11H2,(H,13,14)
InChI Key:
UANMRKQAHHCMDR-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cc1ccc(cc1[N+](=O)[O-])Cl)N
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.025g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.631g/mol
Monoisotopic Mass:
244.025g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Properties