Home Halogens methyl (2S)-2-amino-3-[(5-chlorothiophen-2-yl)formamido]propanoate hydrochloride

methyl (2S)-2-amino-3-[(5-chlorothiophen-2-yl)formamido]propanoate hydrochloride

CAS No.:
1184298-30-3
Catalog Number:
AG01EJNZ
Molecular Formula:
C9H12Cl2N2O3S
Molecular Weight:
299.1742
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Product Description
Catalog Number:
AG01EJNZ
Chemical Name:
methyl (2S)-2-amino-3-[(5-chlorothiophen-2-yl)formamido]propanoate hydrochloride
CAS Number:
1184298-30-3
Molecular Formula:
C9H12Cl2N2O3S
Molecular Weight:
299.1742
MDL Number:
MFCD31665929
IUPAC Name:
methyl (2S)-2-amino-3-[(5-chlorothiophene-2-carbonyl)amino]propanoate;hydrochloride
InChI:
InChI=1S/C9H11ClN2O3S.ClH/c1-15-9(14)5(11)4-12-8(13)6-2-3-7(10)16-6;/h2-3,5H,4,11H2,1H3,(H,12,13);1H/t5-;/m0./s1
InChI Key:
NWRVYFDXBIQQIJ-JEDNCBNOSA-N
SMILES:
COC(=O)[C@H](CNC(=O)c1ccc(s1)Cl)N.Cl
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
297.995g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
299.166g/mol
Monoisotopic Mass:
297.995g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties