Home Halogens methyl 2-amino-2-(5-bromothiophen-3-yl)acetate hydrochloride

methyl 2-amino-2-(5-bromothiophen-3-yl)acetate hydrochloride

CAS No.:
2137481-21-9
Catalog Number:
AG01EL59
Molecular Formula:
C7H9BrClNO2S
Molecular Weight:
286.5739
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Product Description
Catalog Number:
AG01EL59
Chemical Name:
methyl 2-amino-2-(5-bromothiophen-3-yl)acetate hydrochloride
CAS Number:
2137481-21-9
Molecular Formula:
C7H9BrClNO2S
Molecular Weight:
286.5739
MDL Number:
MFCD31559193
IUPAC Name:
methyl 2-amino-2-(5-bromothiophen-3-yl)acetate;hydrochloride
InChI:
InChI=1S/C7H8BrNO2S.ClH/c1-11-7(10)6(9)4-2-5(8)12-3-4;/h2-3,6H,9H2,1H3;1H
InChI Key:
CSJSZKJHKIJQIQ-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1csc(c1)Br)N.Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.923g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
286.568g/mol
Monoisotopic Mass:
284.923g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties