Home Halogens methyl 2-amino-2-(4-chloro-3-fluorophenyl)acetate hydrochloride

methyl 2-amino-2-(4-chloro-3-fluorophenyl)acetate hydrochloride

CAS No.:
1395078-35-9
Catalog Number:
AG01A32K
Molecular Formula:
C9H10Cl2FNO2
Molecular Weight:
254.0856
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Product Description
Catalog Number:
AG01A32K
Chemical Name:
methyl 2-amino-2-(4-chloro-3-fluorophenyl)acetate hydrochloride
CAS Number:
1395078-35-9
Molecular Formula:
C9H10Cl2FNO2
Molecular Weight:
254.0856
MDL Number:
MFCD22628475
IUPAC Name:
methyl 2-amino-2-(4-chloro-3-fluorophenyl)acetate;hydrochloride
InChI:
InChI=1S/C9H9ClFNO2.ClH/c1-14-9(13)8(12)5-2-3-6(10)7(11)4-5;/h2-4,8H,12H2,1H3;1H
InChI Key:
WTVBGDZRYJEHMZ-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(c(c1)F)Cl)N.Cl
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.007g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
254.082g/mol
Monoisotopic Mass:
253.007g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties