Home Aminos methyl 2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoate hydrochloride

methyl 2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoate hydrochloride

CAS No.:
69978-78-5
Catalog Number:
AG01EMJT
Molecular Formula:
C10H13ClFNO3
Molecular Weight:
249.6665
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Product Description
Catalog Number:
AG01EMJT
Chemical Name:
methyl 2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoate hydrochloride
CAS Number:
69978-78-5
Molecular Formula:
C10H13ClFNO3
Molecular Weight:
249.6665
MDL Number:
MFCD31617715
IUPAC Name:
methyl 2-amino-3-(3-fluoro-4-hydroxyphenyl)propanoate;hydrochloride
InChI:
InChI=1S/C10H12FNO3.ClH/c1-15-10(14)8(12)5-6-2-3-9(13)7(11)4-6;/h2-4,8,13H,5,12H2,1H3;1H
InChI Key:
KFNYVMPIVIJGEM-UHFFFAOYSA-N
SMILES:
COC(=O)C(Cc1ccc(c(c1)F)O)N.Cl
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
249.666g/mol
Monoisotopic Mass:
249.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties