Home Other Building Blocks (2R)-2-[(2-iodo-3-methylphenyl)formamido]propanoic acid

(2R)-2-[(2-iodo-3-methylphenyl)formamido]propanoic acid

CAS No.:
1604308-75-9
Catalog Number:
AG01B876
Molecular Formula:
C11H12INO3
Molecular Weight:
333.1223
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Product Description
Catalog Number:
AG01B876
Chemical Name:
(2R)-2-[(2-iodo-3-methylphenyl)formamido]propanoic acid
CAS Number:
1604308-75-9
Molecular Formula:
C11H12INO3
Molecular Weight:
333.1223
MDL Number:
MFCD28246421
IUPAC Name:
(2R)-2-[(2-iodo-3-methylbenzoyl)amino]propanoic acid
InChI:
InChI=1S/C11H12INO3/c1-6-4-3-5-8(9(6)12)10(14)13-7(2)11(15)16/h3-5,7H,1-2H3,(H,13,14)(H,15,16)/t7-/m1/s1
InChI Key:
XMJFHZGKUSUCCG-SSDOTTSWSA-N
SMILES:
C[C@H](C(=O)O)NC(=O)c1cccc(c1I)C
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
332.986g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
333.125g/mol
Monoisotopic Mass:
332.986g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties